3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole

C316H228N12 — CID 157317199

IUPAC3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole
SMILESCC(C)Cc1ccc2c(c1)c1cc(CC(C)C)ccc1n2-c1ccc(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccc(CC(C)C)cc7c7cc(CC(C)C)ccc76)cc5)cc4c3c2)cc1.Cc1c(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)c(C)c5C)cc4c3c2)ccc(-n2c3ccccc3c3ccccc32)c1C.Cc1cc(-n2c3ccccc3c3ccccc32)c(C)cc1-c1ccc2[nH]c3ccc(-c4cc(C)c(-n5c6ccccc6c6ccccc65)cc4C)cc3c2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)ccc3n4-c3ccc(-c4ccc5[nH]c6ccc(-c7ccc(-n8c9ccc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)cc9c9cc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)ccc98)cc7)cc6c5c4)cc3)cc21
InChIInChI=1S/C148H87N3.C64H63N3.2C52H39N3/c1-13-37-123-101(25-1)102-26-2-14-38-124(102)145(123)131-45-21-9-33-109(131)113-67-53-95(83-135(113)145)91-59-73-141-119(79-91)120-80-92(96-54-68-114-110-34-10-22-46-132(110)146(136(114)84-96)125-39-15-3-27-103(125)104-28-4-16-40-126(104)146)60-74-142(120)150(141)99-63-49-87(50-64-99)89-57-71-139-117(77-89)118-78-90(58-72-140(118)149-139)88-51-65-100(66-52-88)151-143-75-61-93(97-55-69-115-111-35-11-23-47-133(111)147(137(115)85-97)127-41-17-5-29-105(127)106-30-6-18-42-128(106)147)81-121(143)122-82-94(62-76-144(122)151)98-56-70-116-112-36-12-24-48-134(112)148(138(116)86-98)129-43-19-7-31-107(129)108-32-8-20-44-130(108)148;1-39(2)29-43-9-25-61-55(33-43)56-34-44(30-40(3)4)10-26-62(56)66(61)51-19-13-47(14-20-51)49-17-23-59-53(37-49)54-38-50(18-24-60(54)65-59)48-15-21-52(22-16-48)67-63-27-11-45(31-41(5)6)35-57(63)58-36-46(32-42(7)8)12-28-64(58)67;1-31-33(3)47(54-49-17-9-5-13-39(49)40-14-6-10-18-50(40)54)27-23-37(31)35-21-25-45-43(29-35)44-30-36(22-26-46(44)53-45)38-24-28-48(34(4)32(38)2)55-51-19-11-7-15-41(51)42-16-8-12-20-52(42)55;1-31-27-51(54-47-17-9-5-13-37(47)38-14-6-10-18-48(38)54)33(3)25-41(31)35-21-23-45-43(29-35)44-30-36(22-24-46(44)53-45)42-26-34(4)52(28-32(42)2)55-49-19-11-7-15-39(49)40-16-8-12-20-50(40)55/h1-86,149H;9-28,33-42,65H,29-32H2,1-8H3;2*5-30,53H,1-4H3
InChIKeyBDSYAHYMUUCXJO-UHFFFAOYSA-N
MW4193.38 g/mol
LogP82.70
Rot. Bonds28

About 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole

3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole (PubChem CID 157317199) has the molecular formula C316H228N12 and a molecular weight of 4193.38 g/mol. Its IUPAC name is 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole.

Molecular Properties

Compound Name3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole
PubChem CID157317199
Molecular FormulaC316H228N12
Molecular Weight4193.38 g/mol
Exact Mass4189.82
IUPAC Name3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole
SMILESCC(C)Cc1ccc2c(c1)c1cc(CC(C)C)ccc1n2-c1ccc(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccc(CC(C)C)cc7c7cc(CC(C)C)ccc76)cc5)cc4c3c2)cc1.Cc1c(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)c(C)c5C)cc4c3c2)ccc(-n2c3ccccc3c3ccccc32)c1C.Cc1cc(-n2c3ccccc3c3ccccc32)c(C)cc1-c1ccc2[nH]c3ccc(-c4cc(C)c(-n5c6ccccc6c6ccccc65)cc4C)cc3c2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)ccc3n4-c3ccc(-c4ccc5[nH]c6ccc(-c7ccc(-n8c9ccc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)cc9c9cc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)ccc98)cc7)cc6c5c4)cc3)cc21
InChIInChI=1S/C148H87N3.C64H63N3.2C52H39N3/c1-13-37-123-101(25-1)102-26-2-14-38-124(102)145(123)131-45-21-9-33-109(131)113-67-53-95(83-135(113)145)91-59-73-141-119(79-91)120-80-92(96-54-68-114-110-34-10-22-46-132(110)146(136(114)84-96)125-39-15-3-27-103(125)104-28-4-16-40-126(104)146)60-74-142(120)150(141)99-63-49-87(50-64-99)89-57-71-139-117(77-89)118-78-90(58-72-140(118)149-139)88-51-65-100(66-52-88)151-143-75-61-93(97-55-69-115-111-35-11-23-47-133(111)147(137(115)85-97)127-41-17-5-29-105(127)106-30-6-18-42-128(106)147)81-121(143)122-82-94(62-76-144(122)151)98-56-70-116-112-36-12-24-48-134(112)148(138(116)86-98)129-43-19-7-31-107(129)108-32-8-20-44-130(108)148;1-39(2)29-43-9-25-61-55(33-43)56-34-44(30-40(3)4)10-26-62(56)66(61)51-19-13-47(14-20-51)49-17-23-59-53(37-49)54-38-50(18-24-60(54)65-59)48-15-21-52(22-16-48)67-63-27-11-45(31-41(5)6)35-57(63)58-36-46(32-42(7)8)12-28-64(58)67;1-31-33(3)47(54-49-17-9-5-13-39(49)40-14-6-10-18-50(40)54)27-23-37(31)35-21-25-45-43(29-35)44-30-36(22-26-46(44)53-45)38-24-28-48(34(4)32(38)2)55-51-19-11-7-15-41(51)42-16-8-12-20-52(42)55;1-31-27-51(54-47-17-9-5-13-37(47)38-14-6-10-18-48(38)54)33(3)25-41(31)35-21-23-45-43(29-35)44-30-36(22-24-46(44)53-45)42-26-34(4)52(28-32(42)2)55-49-19-11-7-15-39(49)40-16-8-12-20-50(40)55/h1-86,149H;9-28,33-42,65H,29-32H2,1-8H3;2*5-30,53H,1-4H3
InChIKeyBDSYAHYMUUCXJO-UHFFFAOYSA-N
XLogP82.70
TPSA102.60 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds28
Heavy Atoms328
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004193.38
LogP ≤ 582.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole?
The IUPAC name of 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole (CID 157317199) is 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole.
What is the SMILES notation for 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole?
The canonical SMILES for 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole is CC(C)Cc1ccc2c(c1)c1cc(CC(C)C)ccc1n2-c1ccc(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccc(CC(C)C)cc7c7cc(CC(C)C)ccc76)cc5)cc4c3c2)cc1.Cc1c(-c2ccc3[nH]c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)c(C)c5C)cc4c3c2)ccc(-n2c3ccccc3c3ccccc32)c1C.Cc1cc(-n2c3ccccc3c3ccccc32)c(C)cc1-c1ccc2[nH]c3ccc(-c4cc(C)c(-n5c6ccccc6c6ccccc65)cc4C)cc3c2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)ccc3n4-c3ccc(-c4ccc5[nH]c6ccc(-c7ccc(-n8c9ccc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)cc9c9cc(-c%10ccc%11c(c%10)C%10(c%12ccccc%12-c%12ccccc%12%10)c%10ccccc%10-%11)ccc98)cc7)cc6c5c4)cc3)cc21.
What is the InChIKey of 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole?
The InChIKey is BDSYAHYMUUCXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C148H87N3.C64H63N3.2C52H39N3/c1-13-37-123-101(25-1)102-26-2-14-38-124(102)145(123)131-45-21-9-33-109(131)113-67-53-95(83-135(113)145)91-59-73-141-119(79-91)120-80-92(96-54-68-114-110-34-10-22-46-132(110)146(136(114)84-96)125-39-15-3-27-103(125)104-28-4-16-40-126(104)146)60-74-142(120)150(141)99-63-49-87(50-64-99)89-57-71-139-117(77-89)118-78-90(58-72-140(118)149-139)88-51-65-100(66-52-88)151-143-75-61-93(97-55-69-115-111-35-11-23-47-133(111)147(137(115)85-97)127-41-17-5-29-105(127)106-30-6-18-42-128(106)147)81-121(143)122-82-94(62-76-144(122)151)98-56-70-116-112-36-12-24-48-134(112)148(138(116)86-98)129-43-19-7-31-107(129)108-32-8-20-44-130(108)148;1-39(2)29-43-9-25-61-55(33-43)56-34-44(30-40(3)4)10-26-62(56)66(61)51-19-13-47(14-20-51)49-17-23-59-53(37-49)54-38-50(18-24-60(54)65-59)48-15-21-52(22-16-48)67-63-27-11-45(31-41(5)6)35-57(63)58-36-46(32-42(7)8)12-28-64(58)67;1-31-33(3)47(54-49-17-9-5-13-39(49)40-14-6-10-18-50(40)54)27-23-37(31)35-21-25-45-43(29-35)44-30-36(22-26-46(44)53-45)38-24-28-48(34(4)32(38)2)55-51-19-11-7-15-41(51)42-16-8-12-20-52(42)55;1-31-27-51(54-47-17-9-5-13-37(47)38-14-6-10-18-48(38)54)33(3)25-41(31)35-21-23-45-43(29-35)44-30-36(22-24-46(44)53-45)42-26-34(4)52(28-32(42)2)55-49-19-11-7-15-39(49)40-16-8-12-20-50(40)55/h1-86,149H;9-28,33-42,65H,29-32H2,1-8H3;2*5-30,53H,1-4H3.
What are the key properties of 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole?
3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole has a molecular weight of 4193.38 g/mol, XLogP of 82.70, 28 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-carbazole;3,6-bis(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-carbazole;9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-carbazol-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole is sourced from PubChem (CID 157317199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).