9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene

C399H320N8 — CID 161047664

IUPAC9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene
SMILESC(=C/c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1-2)\c1ccc(N(c2ccccc2)c2ccccc2)cc1.CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3ccccc3-c3ccc(-c4ccc5c(-c6ccccc6)c6c(c(-c7ccccc7)c5c4)-c4cccc5cccc-6c45)cc32)cc1.Cc1ccc(N(c2ccc(C(C)C)cc2)c2cc3c4ccc(C(C)C)cc4c(N(c4ccc(C)cc4)c4ccc(C(C)C)cc4)cc3c3ccc(C(C)C)cc23)cc1.Cc1ccc(N(c2ccc(C)cc2)c2cc3c4ccccc4c(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3c3ccccc23)cc1.Cc1cccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2cc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccccc8)c8cccc(C)c8)ccc6-7)ccc4-5)ccc2-3)c1.c1ccc(-c2ccc3c(-c4ccccc4)c4c(c(-c5ccccc5)c3c2)-c2ccc(-c3ccccc3)c3cccc-4c23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4c-5c(-c5ccccc5)c5ccccc5c4-c4ccccc4)ccc3c2)cc1
InChIInChI=1S/C71H60N2.C69H60.C65H46N2.C56H58N2.C48H30.C46H38N2.C44H28/c1-45-17-15-23-53(37-45)72(51-19-11-9-12-20-51)55-29-35-61-59-33-27-49(41-65(59)70(5,6)67(61)43-55)47-25-31-57-58-32-26-48(40-64(58)69(3,4)63(57)39-47)50-28-34-60-62-36-30-56(44-68(62)71(7,8)66(60)42-50)73(52-21-13-10-14-22-52)54-24-16-18-46(2)38-54;1-3-5-7-11-21-47-33-39-54(40-34-47)69(55-41-35-48(36-42-55)22-12-8-6-4-2)62-32-18-17-29-56(62)57-43-37-53(46-63(57)69)52-38-44-58-61(45-52)66(51-25-15-10-16-26-51)68-60-31-20-28-49-27-19-30-59(64(49)60)67(68)65(58)50-23-13-9-14-24-50;1-5-17-51(18-6-1)66(52-19-7-2-8-20-52)55-39-33-47(34-40-55)29-31-49-37-43-59-60-44-38-50(46-64(60)65(63(59)45-49)61-27-15-13-25-57(61)58-26-14-16-28-62(58)65)32-30-48-35-41-56(42-36-48)67(53-21-9-3-10-22-53)54-23-11-4-12-24-54;1-35(2)41-15-25-47(26-16-41)57(45-21-11-39(9)12-22-45)55-33-51-50-30-20-44(38(7)8)32-54(50)56(34-52(51)49-29-19-43(37(5)6)31-53(49)55)58(46-23-13-40(10)14-24-46)48-27-17-42(18-28-48)36(3)4;1-4-13-31(14-5-1)34-23-24-36-30-37(26-25-35(36)29-34)38-27-28-43-46-39(38)21-12-22-42(46)47-44(32-15-6-2-7-16-32)40-19-10-11-20-41(40)45(48(43)47)33-17-8-3-9-18-33;1-31-13-21-35(22-14-31)47(36-23-15-32(2)16-24-36)45-29-43-40-10-6-8-12-42(40)46(30-44(43)39-9-5-7-11-41(39)45)48(37-25-17-33(3)18-26-37)38-27-19-34(4)20-28-38;1-5-14-29(15-6-1)33-24-25-36-39(28-33)41(32-20-11-4-12-21-32)44-38-27-26-34(30-16-7-2-8-17-30)35-22-13-23-37(42(35)38)43(44)40(36)31-18-9-3-10-19-31/h9-44H,1-8H3;9-10,13-20,23-46H,3-8,11-12,21-22H2,1-2H3;1-46H;11-38H,1-10H3;1-30H;5-30H,1-4H3;1-28H/b;;31-29+,32-30+;;;;
InChIKeyUBSCLYAKXRJSOZ-OWIZJOCKSA-N
MW5227.01 g/mol
LogP112.34
Rot. Bonds57

About 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene

9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene (PubChem CID 161047664) has the molecular formula C399H320N8 and a molecular weight of 5227.01 g/mol. Its IUPAC name is 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene.

Molecular Properties

Compound Name9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene
PubChem CID161047664
Molecular FormulaC399H320N8
Molecular Weight5227.01 g/mol
Exact Mass5222.53
IUPAC Name9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene
SMILESC(=C/c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1-2)\c1ccc(N(c2ccccc2)c2ccccc2)cc1.CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3ccccc3-c3ccc(-c4ccc5c(-c6ccccc6)c6c(c(-c7ccccc7)c5c4)-c4cccc5cccc-6c45)cc32)cc1.Cc1ccc(N(c2ccc(C(C)C)cc2)c2cc3c4ccc(C(C)C)cc4c(N(c4ccc(C)cc4)c4ccc(C(C)C)cc4)cc3c3ccc(C(C)C)cc23)cc1.Cc1ccc(N(c2ccc(C)cc2)c2cc3c4ccccc4c(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3c3ccccc23)cc1.Cc1cccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2cc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccccc8)c8cccc(C)c8)ccc6-7)ccc4-5)ccc2-3)c1.c1ccc(-c2ccc3c(-c4ccccc4)c4c(c(-c5ccccc5)c3c2)-c2ccc(-c3ccccc3)c3cccc-4c23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4c-5c(-c5ccccc5)c5ccccc5c4-c4ccccc4)ccc3c2)cc1
InChIInChI=1S/C71H60N2.C69H60.C65H46N2.C56H58N2.C48H30.C46H38N2.C44H28/c1-45-17-15-23-53(37-45)72(51-19-11-9-12-20-51)55-29-35-61-59-33-27-49(41-65(59)70(5,6)67(61)43-55)47-25-31-57-58-32-26-48(40-64(58)69(3,4)63(57)39-47)50-28-34-60-62-36-30-56(44-68(62)71(7,8)66(60)42-50)73(52-21-13-10-14-22-52)54-24-16-18-46(2)38-54;1-3-5-7-11-21-47-33-39-54(40-34-47)69(55-41-35-48(36-42-55)22-12-8-6-4-2)62-32-18-17-29-56(62)57-43-37-53(46-63(57)69)52-38-44-58-61(45-52)66(51-25-15-10-16-26-51)68-60-31-20-28-49-27-19-30-59(64(49)60)67(68)65(58)50-23-13-9-14-24-50;1-5-17-51(18-6-1)66(52-19-7-2-8-20-52)55-39-33-47(34-40-55)29-31-49-37-43-59-60-44-38-50(46-64(60)65(63(59)45-49)61-27-15-13-25-57(61)58-26-14-16-28-62(58)65)32-30-48-35-41-56(42-36-48)67(53-21-9-3-10-22-53)54-23-11-4-12-24-54;1-35(2)41-15-25-47(26-16-41)57(45-21-11-39(9)12-22-45)55-33-51-50-30-20-44(38(7)8)32-54(50)56(34-52(51)49-29-19-43(37(5)6)31-53(49)55)58(46-23-13-40(10)14-24-46)48-27-17-42(18-28-48)36(3)4;1-4-13-31(14-5-1)34-23-24-36-30-37(26-25-35(36)29-34)38-27-28-43-46-39(38)21-12-22-42(46)47-44(32-15-6-2-7-16-32)40-19-10-11-20-41(40)45(48(43)47)33-17-8-3-9-18-33;1-31-13-21-35(22-14-31)47(36-23-15-32(2)16-24-36)45-29-43-40-10-6-8-12-42(40)46(30-44(43)39-9-5-7-11-41(39)45)48(37-25-17-33(3)18-26-37)38-27-19-34(4)20-28-38;1-5-14-29(15-6-1)33-24-25-36-39(28-33)41(32-20-11-4-12-21-32)44-38-27-26-34(30-16-7-2-8-17-30)35-22-13-23-37(42(35)38)43(44)40(36)31-18-9-3-10-19-31/h9-44H,1-8H3;9-10,13-20,23-46H,3-8,11-12,21-22H2,1-2H3;1-46H;11-38H,1-10H3;1-30H;5-30H,1-4H3;1-28H/b;;31-29+,32-30+;;;;
InChIKeyUBSCLYAKXRJSOZ-OWIZJOCKSA-N
XLogP112.34
TPSA25.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds57
Heavy Atoms407
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5005227.01
LogP ≤ 5112.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene?
The IUPAC name of 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene (CID 161047664) is 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene.
What is the SMILES notation for 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene?
The canonical SMILES for 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene is C(=C/c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1-2)\c1ccc(N(c2ccccc2)c2ccccc2)cc1.CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3ccccc3-c3ccc(-c4ccc5c(-c6ccccc6)c6c(c(-c7ccccc7)c5c4)-c4cccc5cccc-6c45)cc32)cc1.Cc1ccc(N(c2ccc(C(C)C)cc2)c2cc3c4ccc(C(C)C)cc4c(N(c4ccc(C)cc4)c4ccc(C(C)C)cc4)cc3c3ccc(C(C)C)cc23)cc1.Cc1ccc(N(c2ccc(C)cc2)c2cc3c4ccccc4c(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3c3ccccc23)cc1.Cc1cccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2cc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc7c(c6)C(C)(C)c6cc(N(c8ccccc8)c8cccc(C)c8)ccc6-7)ccc4-5)ccc2-3)c1.c1ccc(-c2ccc3c(-c4ccccc4)c4c(c(-c5ccccc5)c3c2)-c2ccc(-c3ccccc3)c3cccc-4c23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4c-5c(-c5ccccc5)c5ccccc5c4-c4ccccc4)ccc3c2)cc1.
What is the InChIKey of 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene?
The InChIKey is UBSCLYAKXRJSOZ-OWIZJOCKSA-N. The full InChI is InChI=1S/C71H60N2.C69H60.C65H46N2.C56H58N2.C48H30.C46H38N2.C44H28/c1-45-17-15-23-53(37-45)72(51-19-11-9-12-20-51)55-29-35-61-59-33-27-49(41-65(59)70(5,6)67(61)43-55)47-25-31-57-58-32-26-48(40-64(58)69(3,4)63(57)39-47)50-28-34-60-62-36-30-56(44-68(62)71(7,8)66(60)42-50)73(52-21-13-10-14-22-52)54-24-16-18-46(2)38-54;1-3-5-7-11-21-47-33-39-54(40-34-47)69(55-41-35-48(36-42-55)22-12-8-6-4-2)62-32-18-17-29-56(62)57-43-37-53(46-63(57)69)52-38-44-58-61(45-52)66(51-25-15-10-16-26-51)68-60-31-20-28-49-27-19-30-59(64(49)60)67(68)65(58)50-23-13-9-14-24-50;1-5-17-51(18-6-1)66(52-19-7-2-8-20-52)55-39-33-47(34-40-55)29-31-49-37-43-59-60-44-38-50(46-64(60)65(63(59)45-49)61-27-15-13-25-57(61)58-26-14-16-28-62(58)65)32-30-48-35-41-56(42-36-48)67(53-21-9-3-10-22-53)54-23-11-4-12-24-54;1-35(2)41-15-25-47(26-16-41)57(45-21-11-39(9)12-22-45)55-33-51-50-30-20-44(38(7)8)32-54(50)56(34-52(51)49-29-19-43(37(5)6)31-53(49)55)58(46-23-13-40(10)14-24-46)48-27-17-42(18-28-48)36(3)4;1-4-13-31(14-5-1)34-23-24-36-30-37(26-25-35(36)29-34)38-27-28-43-46-39(38)21-12-22-42(46)47-44(32-15-6-2-7-16-32)40-19-10-11-20-41(40)45(48(43)47)33-17-8-3-9-18-33;1-31-13-21-35(22-14-31)47(36-23-15-32(2)16-24-36)45-29-43-40-10-6-8-12-42(40)46(30-44(43)39-9-5-7-11-41(39)45)48(37-25-17-33(3)18-26-37)38-27-19-34(4)20-28-38;1-5-14-29(15-6-1)33-24-25-36-39(28-33)41(32-20-11-4-12-21-32)44-38-27-26-34(30-16-7-2-8-17-30)35-22-13-23-37(42(35)38)43(44)40(36)31-18-9-3-10-19-31/h9-44H,1-8H3;9-10,13-20,23-46H,3-8,11-12,21-22H2,1-2H3;1-46H;11-38H,1-10H3;1-30H;5-30H,1-4H3;1-28H/b;;31-29+,32-30+;;;;.
What are the key properties of 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene?
9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene has a molecular weight of 5227.01 g/mol, XLogP of 112.34, 57 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[9,9-bis(4-hexylphenyl)fluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene;6-N,12-N-bis(4-methylphenyl)-2,8-di(propan-2-yl)-6-N,12-N-bis(4-propan-2-ylphenyl)chrysene-6,12-diamine;7-[7-[9,9-dimethyl-7-(N-(3-methylphenyl)anilino)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethyl-N-(3-methylphenyl)-N-phenylfluoren-2-amine;N,N-diphenyl-4-[(E)-2-[7'-[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]aniline;7,12-diphenyl-3-(6-phenylnaphthalen-2-yl)benzo[k]fluoranthene;6-N,6-N,12-N,12-N-tetrakis(4-methylphenyl)chrysene-6,12-diamine;4,7,9,12-tetraphenylbenzo[k]fluoranthene is sourced from PubChem (CID 161047664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).