2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole

C410H282N10O7P4S — CID 158667602

IUPAC2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc2c(c1)C1(c3cc(C=C(c4ccccc4)c4ccccc4)ccc3-2)c2cc(C=C(c3ccccc3)c3ccccc3)ccc2-c2ccc(C=C(c3ccccc3)c3ccccc3)cc21.COc1ccc(-c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(-c7ccccc7)cc6)ccc5-4)c4cc(-c5ccc(-c6ccccc6)cc5)ccc4-c4ccc(-c5ccc(-c6ccc(OC)cc6)cc5)cc43)cc2)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc2sc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3c2c1.O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(=O)(c1ccccc1)c1ccccc1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)C1(c3cc(-n4c5ccccc5c5ccccc54)ccc3-2)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C81H56.C75H52O2.C73H44N4.C73H52N4.C36H24N2.C36H28O3P2.C36H26O2P2S/c1-9-25-61(26-10-1)73(62-27-11-2-12-28-62)49-57-41-45-69-70-46-42-58(50-74(63-29-13-3-14-30-63)64-31-15-4-16-32-64)54-78(70)81(77(69)53-57)79-55-59(51-75(65-33-17-5-18-34-65)66-35-19-6-20-36-66)43-47-71(79)72-48-44-60(56-80(72)81)52-76(67-37-21-7-22-38-67)68-39-23-8-24-40-68;1-76-65-37-29-55(30-38-65)53-17-25-59(26-18-53)63-35-43-69-67-41-33-61(57-21-13-51(14-22-57)49-9-5-3-6-10-49)45-71(67)75(73(69)47-63)72-46-62(58-23-15-52(16-24-58)50-11-7-4-8-12-50)34-42-68(72)70-44-36-64(48-74(70)75)60-27-19-54(20-28-60)56-31-39-66(77-2)40-32-56;1-9-25-65-53(17-1)54-18-2-10-26-66(54)74(65)45-33-37-49-50-38-34-46(75-67-27-11-3-19-55(67)56-20-4-12-28-68(56)75)42-62(50)73(61(49)41-45)63-43-47(76-69-29-13-5-21-57(69)58-22-6-14-30-70(58)76)35-39-51(63)52-40-36-48(44-64(52)73)77-71-31-15-7-23-59(71)60-24-8-16-32-72(60)77;1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-5-19-33-29(15-1)30-16-2-6-20-34(30)37(33)27-13-9-11-25(23-27)26-12-10-14-28(24-26)38-35-21-7-3-17-31(35)32-18-4-8-22-36(32)38;37-40(29-17-5-1-6-18-29,30-19-7-2-8-20-30)35-27-15-13-25-33(35)39-34-26-14-16-28-36(34)41(38,31-21-9-3-10-22-31)32-23-11-4-12-24-32;37-39(27-13-5-1-6-14-27,28-15-7-2-8-16-28)31-21-23-35-33(25-31)34-26-32(22-24-36(34)41-35)40(38,29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-56H;3-48H,1-2H3;1-44H;1-52H;1-24H;1-28H;1-26H
InChIKeyIDOBFWOVBOSKAK-UHFFFAOYSA-N
MW5616.79 g/mol
LogP101.74
Rot. Bonds55

About 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole

2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole (PubChem CID 158667602) has the molecular formula C410H282N10O7P4S and a molecular weight of 5616.79 g/mol. Its IUPAC name is 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole.

Molecular Properties

Compound Name2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
PubChem CID158667602
Molecular FormulaC410H282N10O7P4S
Molecular Weight5616.79 g/mol
Exact Mass5612.07
IUPAC Name2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc2c(c1)C1(c3cc(C=C(c4ccccc4)c4ccccc4)ccc3-2)c2cc(C=C(c3ccccc3)c3ccccc3)ccc2-c2ccc(C=C(c3ccccc3)c3ccccc3)cc21.COc1ccc(-c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(-c7ccccc7)cc6)ccc5-4)c4cc(-c5ccc(-c6ccccc6)cc5)ccc4-c4ccc(-c5ccc(-c6ccc(OC)cc6)cc5)cc43)cc2)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc2sc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3c2c1.O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(=O)(c1ccccc1)c1ccccc1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)C1(c3cc(-n4c5ccccc5c5ccccc54)ccc3-2)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C81H56.C75H52O2.C73H44N4.C73H52N4.C36H24N2.C36H28O3P2.C36H26O2P2S/c1-9-25-61(26-10-1)73(62-27-11-2-12-28-62)49-57-41-45-69-70-46-42-58(50-74(63-29-13-3-14-30-63)64-31-15-4-16-32-64)54-78(70)81(77(69)53-57)79-55-59(51-75(65-33-17-5-18-34-65)66-35-19-6-20-36-66)43-47-71(79)72-48-44-60(56-80(72)81)52-76(67-37-21-7-22-38-67)68-39-23-8-24-40-68;1-76-65-37-29-55(30-38-65)53-17-25-59(26-18-53)63-35-43-69-67-41-33-61(57-21-13-51(14-22-57)49-9-5-3-6-10-49)45-71(67)75(73(69)47-63)72-46-62(58-23-15-52(16-24-58)50-11-7-4-8-12-50)34-42-68(72)70-44-36-64(48-74(70)75)60-27-19-54(20-28-60)56-31-39-66(77-2)40-32-56;1-9-25-65-53(17-1)54-18-2-10-26-66(54)74(65)45-33-37-49-50-38-34-46(75-67-27-11-3-19-55(67)56-20-4-12-28-68(56)75)42-62(50)73(61(49)41-45)63-43-47(76-69-29-13-5-21-57(69)58-22-6-14-30-70(58)76)35-39-51(63)52-40-36-48(44-64(52)73)77-71-31-15-7-23-59(71)60-24-8-16-32-72(60)77;1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-5-19-33-29(15-1)30-16-2-6-20-34(30)37(33)27-13-9-11-25(23-27)26-12-10-14-28(24-26)38-35-21-7-3-17-31(35)32-18-4-8-22-36(32)38;37-40(29-17-5-1-6-18-29,30-19-7-2-8-20-30)35-27-15-13-25-33(35)39-34-26-14-16-28-36(34)41(38,31-21-9-3-10-22-31)32-23-11-4-12-24-32;37-39(27-13-5-1-6-14-27,28-15-7-2-8-16-28)31-21-23-35-33(25-31)34-26-32(22-24-36(34)41-35)40(38,29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-56H;3-48H,1-2H3;1-44H;1-52H;1-24H;1-28H;1-26H
InChIKeyIDOBFWOVBOSKAK-UHFFFAOYSA-N
XLogP101.74
TPSA138.51 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds55
Heavy Atoms432
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005616.79
LogP ≤ 5101.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole with MolForge

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Related Compounds

2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];2,2',7,7'-tetrakis[4-(4-methoxyphenyl)phenyl]-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
CID 161131230
2-(4-tert-butylphenyl)-5-[2'-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2-yl]-1,3,4-oxadiazole;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];2,2',7,7'-tetrakis[4-(4-methoxyphenyl)phenyl]-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
CID 160625053
[4-[4-[2'-[4-[4-(hydroxymethyl)phenyl]phenyl]-7,7'-bis[4-(4-methoxyphenyl)phenyl]-9,9'-spirobi[fluorene]-2-yl]phenyl]phenyl]methanol;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
CID 160508928
2,7'-bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]-9,9'-spirobi[fluorene]-2'-amine;[4-[4-[2'-[4-[4-(hydroxymethyl)phenyl]phenyl]-7,7'-bis[4-(4-methoxyphenyl)phenyl]-9,9'-spirobi[fluorene]-2-yl]phenyl]phenyl]methanol;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
CID 159296901
2-N'-[4-[4-[3-[4-(N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenylanilino)phenyl]phenyl]phenyl]phenyl]-7-N'-phenyl-2-N'-(4-phenylphenyl)-7-N'-[4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2',7'-diamine
CID 167023334
3-carbazol-9-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 146578528
N-(9,9-diphenylfluoren-2-yl)-N-[4-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]dibenzothiophen-2-amine
CID 89426464
9-dibenzothiophen-2-yl-N-(9,9-dimethylfluoren-2-yl)-N-(4-methoxyphenyl)carbazol-2-amine
CID 118333317
4-(3-carbazol-9-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 146577847
7-carbazol-9-yl-9,9-dimethyl-N,N-bis[3-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 58390067
N-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)triphenylen-2-amine;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 159641615
7-carbazol-9-yl-9,9-dimethyl-N-(3-naphthalen-2-ylphenyl)-N-phenylfluoren-2-amine
CID 58390006

Frequently Asked Questions

What is the IUPAC name of 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole?
The IUPAC name of 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole (CID 158667602) is 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole.
What is the SMILES notation for 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole?
The canonical SMILES for 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole is C(=C(c1ccccc1)c1ccccc1)c1ccc2c(c1)C1(c3cc(C=C(c4ccccc4)c4ccccc4)ccc3-2)c2cc(C=C(c3ccccc3)c3ccccc3)ccc2-c2ccc(C=C(c3ccccc3)c3ccccc3)cc21.COc1ccc(-c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(-c7ccccc7)cc6)ccc5-4)c4cc(-c5ccc(-c6ccccc6)cc5)ccc4-c4ccc(-c5ccc(-c6ccc(OC)cc6)cc5)cc43)cc2)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc2sc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3c2c1.O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(=O)(c1ccccc1)c1ccccc1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)C1(c3cc(-n4c5ccccc5c5ccccc54)ccc3-2)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.
What is the InChIKey of 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole?
The InChIKey is IDOBFWOVBOSKAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C81H56.C75H52O2.C73H44N4.C73H52N4.C36H24N2.C36H28O3P2.C36H26O2P2S/c1-9-25-61(26-10-1)73(62-27-11-2-12-28-62)49-57-41-45-69-70-46-42-58(50-74(63-29-13-3-14-30-63)64-31-15-4-16-32-64)54-78(70)81(77(69)53-57)79-55-59(51-75(65-33-17-5-18-34-65)66-35-19-6-20-36-66)43-47-71(79)72-48-44-60(56-80(72)81)52-76(67-37-21-7-22-38-67)68-39-23-8-24-40-68;1-76-65-37-29-55(30-38-65)53-17-25-59(26-18-53)63-35-43-69-67-41-33-61(57-21-13-51(14-22-57)49-9-5-3-6-10-49)45-71(67)75(73(69)47-63)72-46-62(58-23-15-52(16-24-58)50-11-7-4-8-12-50)34-42-68(72)70-44-36-64(48-74(70)75)60-27-19-54(20-28-60)56-31-39-66(77-2)40-32-56;1-9-25-65-53(17-1)54-18-2-10-26-66(54)74(65)45-33-37-49-50-38-34-46(75-67-27-11-3-19-55(67)56-20-4-12-28-68(56)75)42-62(50)73(61(49)41-45)63-43-47(76-69-29-13-5-21-57(69)58-22-6-14-30-70(58)76)35-39-51(63)52-40-36-48(44-64(52)73)77-71-31-15-7-23-59(71)60-24-8-16-32-72(60)77;1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-5-19-33-29(15-1)30-16-2-6-20-34(30)37(33)27-13-9-11-25(23-27)26-12-10-14-28(24-26)38-35-21-7-3-17-31(35)32-18-4-8-22-36(32)38;37-40(29-17-5-1-6-18-29,30-19-7-2-8-20-30)35-27-15-13-25-33(35)39-34-26-14-16-28-36(34)41(38,31-21-9-3-10-22-31)32-23-11-4-12-24-32;37-39(27-13-5-1-6-14-27,28-15-7-2-8-16-28)31-21-23-35-33(25-31)34-26-32(22-24-36(34)41-35)40(38,29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-56H;3-48H,1-2H3;1-44H;1-52H;1-24H;1-28H;1-26H.
What are the key properties of 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole?
2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole has a molecular weight of 5616.79 g/mol, XLogP of 101.74, 55 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-bis(diphenylphosphoryl)dibenzothiophene;2,2'-bis[4-(4-methoxyphenyl)phenyl]-7,7'-bis(4-phenylphenyl)-9,9'-spirobi[fluorene];9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;1-diphenylphosphoryl-2-(2-diphenylphosphorylphenoxy)benzene;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;2,2',7,7'-tetrakis(2,2-diphenylethenyl)-9,9'-spirobi[fluorene];9-[2',7,7'-tri(carbazol-9-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole is sourced from PubChem (CID 158667602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).