About 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline
2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline (PubChem CID 158055047) has the molecular formula C410H280N12O
and a molecular weight of 5390.83 g/mol. Its IUPAC name is 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline.
Frequently Asked Questions
What is the IUPAC name of 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline?
The IUPAC name of 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline (CID 158055047) is 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline.
What is the SMILES notation for 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline?
The canonical SMILES for 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline is COc1ccc(N(c2ccc(C)cc2)c2ccccc2-c2ccc(-c3cc4c(c5ccccc35)c3ccccc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccccc2-c2ccc(-c3cc4c(c5ccccc35)c3c5ccccc5ccc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2-c2ccc(-c3cc4c(c5ccccc35)c3cc5ccccc5cc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2-c2ccc(-c3ccc4c5c6ccccc6c6ccccc6c5n(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)c4c3)cc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2-c2ccc(-c3ccc4c5ccc6ccccc6c5n(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)c4c3)cc2)cc1.c1ccc(N(c2ccccc2-c2ccc(-c3ccc4c5cc6ccccc6cc5n(-c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c4c3)cc2)c2cccc3ccccc23)cc1.
What is the InChIKey of 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline?
The InChIKey is FJYFNSGIAHXTRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H50N2.3C69H46N2.C67H48N2O.C65H44N2/c1-47-29-38-54(39-30-47)72(55-40-31-48(2)32-41-55)66-28-16-14-22-57(66)50-33-35-51(36-34-50)63-46-68-70(62-26-12-11-24-59(62)63)69-58-23-10-9-17-49(58)37-44-67(69)73(68)56-42-43-61-60-25-13-15-27-64(60)71(65(61)45-56,52-18-5-3-6-19-52)53-20-7-4-8-21-53;1-5-21-50(22-6-1)69(51-23-7-2-8-24-51)63-35-19-17-32-58(63)62-46-54(42-44-64(62)69)71-66-45-49(41-43-61(66)67-59-33-15-13-30-56(59)57-31-14-16-34-60(57)68(67)71)47-37-39-48(40-38-47)55-29-18-20-36-65(55)70(52-25-9-3-10-26-52)53-27-11-4-12-28-53;1-5-23-51(24-6-1)69(52-25-7-2-8-26-52)63-35-19-17-33-58(63)59-42-41-55(45-64(59)69)71-66-44-50-22-14-13-21-49(50)43-62(66)68-60-34-16-15-32-57(60)61(46-67(68)71)48-39-37-47(38-40-48)56-31-18-20-36-65(56)70(53-27-9-3-10-28-53)54-29-11-4-12-30-54;1-4-23-53(24-5-1)69(54-25-6-2-7-26-54)63-32-16-14-31-59(63)60-42-40-56(46-64(60)69)71-67-45-52(39-41-61(67)62-43-50-20-10-11-21-51(50)44-68(62)71)47-35-37-49(38-36-47)58-30-15-17-33-65(58)70(55-27-8-3-9-28-55)66-34-18-22-48-19-12-13-29-57(48)66;1-45-29-35-50(36-30-45)68(51-37-40-53(70-2)41-38-51)63-27-15-12-21-54(63)46-31-33-47(34-32-46)60-44-65-66(58-24-10-9-22-55(58)60)59-25-13-16-28-64(59)69(65)52-39-42-57-56-23-11-14-26-61(56)67(62(57)43-52,48-17-5-3-6-18-48)49-19-7-4-8-20-49;1-5-20-49(21-6-1)65(50-22-7-2-8-23-50)60-31-17-15-30-56(60)59-44-53(39-42-61(59)65)67-63-43-48(38-40-57(63)58-41-37-46-19-13-14-29-55(46)64(58)67)45-33-35-47(36-34-45)54-28-16-18-32-62(54)66(51-24-9-3-10-25-51)52-26-11-4-12-27-52/h3-46H,1-2H3;3*1-46H;3-44H,1-2H3;1-44H.
What are the key properties of 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline?
2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline has a molecular weight of 5390.83 g/mol, XLogP of 108.17, 49 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]phenyl]-N,N-bis(4-methylphenyl)aniline;2-[4-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]phenyl]-N,N-diphenylaniline;2-[4-[21-(9,9-diphenylfluoren-3-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-yl]phenyl]-N,N-diphenylaniline;2-[4-[11-(9,9-diphenylfluoren-3-yl)benzo[a]carbazol-9-yl]phenyl]-N,N-diphenylaniline;N-[2-[4-[5-(9,9-diphenylfluoren-2-yl)benzo[b]carbazol-3-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-[4-[7-(9,9-diphenylfluoren-2-yl)benzo[c]carbazol-5-yl]phenyl]-N-(4-methoxyphenyl)-N-(4-methylphenyl)aniline is sourced from PubChem (CID 158055047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).