potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride

C359H443B2ClKNO57PPdS+ — CID 164989468

IUPACpotassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride
SMILESCCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(B4OC(C)(C)C(C)(C)O4)c(C)cc3-c3cc(C)c(B4OC(C)(C)C(C)(C)O4)cc32)c1.CCCC[PH+](C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CS(=O)(=O)O.Cl.O.[K+].[NH-]c1ccccc1-c1[c-]cccc1.[OH-].[Pd+2]
InChIInChI=1S/C142H168O24.C134H152O24.C46H66B2O4.C24H39P.C12H9N.CH4O3S.ClH.K.2H2O.Pd/c1-18-24-26-28-30-101-78-102(31-29-27-25-19-2)80-115(79-101)140(15)128-89-120(105-36-44-118-116-42-34-103(109-72-93(7)99(13)94(8)73-109)81-130(116)141(132(118)83-105,111-38-32-107(122(85-111)136(145)161-20-3)91-159-66-64-155-58-56-151-50-48-143)113-40-46-134(126(87-113)138(147)163-22-5)165-70-68-157-62-60-153-54-52-149-16)97(11)76-124(128)125-77-98(12)121(90-129(125)140)106-37-45-119-117-43-35-104(110-74-95(9)100(14)96(10)75-110)82-131(117)142(133(119)84-106,112-39-33-108(123(86-112)137(146)162-21-4)92-160-67-65-156-59-57-152-51-49-144)114-41-47-135(127(88-114)139(148)164-23-6)166-71-69-158-63-61-154-55-53-150-17;1-14-16-18-20-22-93-70-94(23-21-19-17-15-2)72-107(71-93)132(11)120-81-112(97-28-36-110-108-34-26-95(101-64-85(3)91(9)86(4)65-101)73-122(108)133(124(110)75-97,103-30-24-99(114(77-103)128(137)138)83-155-58-56-151-50-48-147-42-40-135)105-32-38-126(118(79-105)130(141)142)157-62-60-153-54-52-149-46-44-145-12)89(7)68-116(120)117-69-90(8)113(82-121(117)132)98-29-37-111-109-35-27-96(102-66-87(5)92(10)88(6)67-102)74-123(109)134(125(111)76-98,104-31-25-100(115(78-104)129(139)140)84-156-59-57-152-51-49-148-43-41-136)106-33-39-127(119(80-106)131(143)144)158-63-61-154-55-53-150-47-45-146-13;1-14-16-18-20-22-33-26-34(23-21-19-17-15-2)28-35(27-33)46(13)38-29-40(47-49-42(5,6)43(7,8)50-47)31(3)24-36(38)37-25-32(4)41(30-39(37)46)48-51-44(9,10)45(11,12)52-48;1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;;;;;/h32-47,72-90,143-144H,18-31,48-71,91-92H2,1-17H3;24-39,64-82,135-136H,14-23,40-63,83-84H2,1-13H3,(H,137,138)(H,139,140)(H,141,142)(H,143,144);24-30H,14-23H2,1-13H3;17-22H,2-16H2,1H3;1-6,8-9,13H;1H3,(H,2,3,4);1H;;2*1H2;/q;;;;-2;;;+1;;;+2
InChIKeyNKPHNRXQVDVWNM-UHFFFAOYSA-N
MW5950.08 g/mol
LogP69.34
Rot. Bonds149

About potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride

potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride (PubChem CID 164989468) has the molecular formula C359H443B2ClKNO57PPdS+ and a molecular weight of 5950.08 g/mol. Its IUPAC name is potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride.

Molecular Properties

Compound Namepotassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride
PubChem CID164989468
Molecular FormulaC359H443B2ClKNO57PPdS+
Molecular Weight5950.08 g/mol
Exact Mass5944.98
IUPAC Namepotassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride
SMILESCCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(B4OC(C)(C)C(C)(C)O4)c(C)cc3-c3cc(C)c(B4OC(C)(C)C(C)(C)O4)cc32)c1.CCCC[PH+](C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CS(=O)(=O)O.Cl.O.[K+].[NH-]c1ccccc1-c1[c-]cccc1.[OH-].[Pd+2]
InChIInChI=1S/C142H168O24.C134H152O24.C46H66B2O4.C24H39P.C12H9N.CH4O3S.ClH.K.2H2O.Pd/c1-18-24-26-28-30-101-78-102(31-29-27-25-19-2)80-115(79-101)140(15)128-89-120(105-36-44-118-116-42-34-103(109-72-93(7)99(13)94(8)73-109)81-130(116)141(132(118)83-105,111-38-32-107(122(85-111)136(145)161-20-3)91-159-66-64-155-58-56-151-50-48-143)113-40-46-134(126(87-113)138(147)163-22-5)165-70-68-157-62-60-153-54-52-149-16)97(11)76-124(128)125-77-98(12)121(90-129(125)140)106-37-45-119-117-43-35-104(110-74-95(9)100(14)96(10)75-110)82-131(117)142(133(119)84-106,112-39-33-108(123(86-112)137(146)162-21-4)92-160-67-65-156-59-57-152-51-49-144)114-41-47-135(127(88-114)139(148)164-23-6)166-71-69-158-63-61-154-55-53-150-17;1-14-16-18-20-22-93-70-94(23-21-19-17-15-2)72-107(71-93)132(11)120-81-112(97-28-36-110-108-34-26-95(101-64-85(3)91(9)86(4)65-101)73-122(108)133(124(110)75-97,103-30-24-99(114(77-103)128(137)138)83-155-58-56-151-50-48-147-42-40-135)105-32-38-126(118(79-105)130(141)142)157-62-60-153-54-52-149-46-44-145-12)89(7)68-116(120)117-69-90(8)113(82-121(117)132)98-29-37-111-109-35-27-96(102-66-87(5)92(10)88(6)67-102)74-123(109)134(125(111)76-98,104-31-25-100(115(78-104)129(139)140)84-156-59-57-152-51-49-148-43-41-136)106-33-39-127(119(80-106)131(143)144)158-63-61-154-55-53-150-47-45-146-13;1-14-16-18-20-22-33-26-34(23-21-19-17-15-2)28-35(27-33)46(13)38-29-40(47-49-42(5,6)43(7,8)50-47)31(3)24-36(38)37-25-32(4)41(30-39(37)46)48-51-44(9,10)45(11,12)52-48;1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;;;;;/h32-47,72-90,143-144H,18-31,48-71,91-92H2,1-17H3;24-39,64-82,135-136H,14-23,40-63,83-84H2,1-13H3,(H,137,138)(H,139,140)(H,141,142)(H,143,144);24-30H,14-23H2,1-13H3;17-22H,2-16H2,1H3;1-6,8-9,13H;1H3,(H,2,3,4);1H;;2*1H2;/q;;;;-2;;;+1;;;+2
InChIKeyNKPHNRXQVDVWNM-UHFFFAOYSA-N
XLogP69.34
TPSA770.35 Ų
H-Bond Donors9
H-Bond Acceptors51
Rotatable Bonds149
Heavy Atoms424
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005950.08
LogP ≤ 569.34
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1051

Analyze potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride?
The IUPAC name of potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride (CID 164989468) is potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride.
What is the SMILES notation for potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride?
The canonical SMILES for potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride is CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)O)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)O)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)c(C)cc3-c3cc(C)c(-c4ccc5c(c4)C(c4ccc(COCCOCCOCCO)c(C(=O)OCC)c4)(c4ccc(OCCOCCOCCOC)c(C(=O)OCC)c4)c4cc(-c6cc(C)c(C)c(C)c6)ccc4-5)cc32)c1.CCCCCCc1cc(CCCCCC)cc(C2(C)c3cc(B4OC(C)(C)C(C)(C)O4)c(C)cc3-c3cc(C)c(B4OC(C)(C)C(C)(C)O4)cc32)c1.CCCC[PH+](C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2.CS(=O)(=O)O.Cl.O.[K+].[NH-]c1ccccc1-c1[c-]cccc1.[OH-].[Pd+2].
What is the InChIKey of potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride?
The InChIKey is NKPHNRXQVDVWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C142H168O24.C134H152O24.C46H66B2O4.C24H39P.C12H9N.CH4O3S.ClH.K.2H2O.Pd/c1-18-24-26-28-30-101-78-102(31-29-27-25-19-2)80-115(79-101)140(15)128-89-120(105-36-44-118-116-42-34-103(109-72-93(7)99(13)94(8)73-109)81-130(116)141(132(118)83-105,111-38-32-107(122(85-111)136(145)161-20-3)91-159-66-64-155-58-56-151-50-48-143)113-40-46-134(126(87-113)138(147)163-22-5)165-70-68-157-62-60-153-54-52-149-16)97(11)76-124(128)125-77-98(12)121(90-129(125)140)106-37-45-119-117-43-35-104(110-74-95(9)100(14)96(10)75-110)82-131(117)142(133(119)84-106,112-39-33-108(123(86-112)137(146)162-21-4)92-160-67-65-156-59-57-152-51-49-144)114-41-47-135(127(88-114)139(148)164-23-6)166-71-69-158-63-61-154-55-53-150-17;1-14-16-18-20-22-93-70-94(23-21-19-17-15-2)72-107(71-93)132(11)120-81-112(97-28-36-110-108-34-26-95(101-64-85(3)91(9)86(4)65-101)73-122(108)133(124(110)75-97,103-30-24-99(114(77-103)128(137)138)83-155-58-56-151-50-48-147-42-40-135)105-32-38-126(118(79-105)130(141)142)157-62-60-153-54-52-149-46-44-145-12)89(7)68-116(120)117-69-90(8)113(82-121(117)132)98-29-37-111-109-35-27-96(102-66-87(5)92(10)88(6)67-102)74-123(109)134(125(111)76-98,104-31-25-100(115(78-104)129(139)140)84-156-59-57-152-51-49-148-43-41-136)106-33-39-127(119(80-106)131(143)144)158-63-61-154-55-53-150-47-45-146-13;1-14-16-18-20-22-33-26-34(23-21-19-17-15-2)28-35(27-33)46(13)38-29-40(47-49-42(5,6)43(7,8)50-47)31(3)24-36(38)37-25-32(4)41(30-39(37)46)48-51-44(9,10)45(11,12)52-48;1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;;;;;/h32-47,72-90,143-144H,18-31,48-71,91-92H2,1-17H3;24-39,64-82,135-136H,14-23,40-63,83-84H2,1-13H3,(H,137,138)(H,139,140)(H,141,142)(H,143,144);24-30H,14-23H2,1-13H3;17-22H,2-16H2,1H3;1-6,8-9,13H;1H3,(H,2,3,4);1H;;2*1H2;/q;;;;-2;;;+1;;;+2.
What are the key properties of potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride?
potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride has a molecular weight of 5950.08 g/mol, XLogP of 69.34, 149 rotatable bonds, 9 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;bis(1-adamantyl)-butylphosphanium;5-[2-[7-[9-[3-carboxy-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-9-(3,5-dihexylphenyl)-3,6,9-trimethylfluoren-2-yl]-9-[3-carboxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoic acid;2-[9-(3,5-dihexylphenyl)-3,6,9-trimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-2-yl]-3,6,9-trimethylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-7-(3,4,5-trimethylphenyl)fluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate;methanesulfonic acid;palladium(2+);(2-phenylphenyl)azanide;hydroxide;hydrate;hydrochloride is sourced from PubChem (CID 164989468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).