2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole

C146H90N6 — CID 161056852

IUPAC2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6c(cccc46)-c4ccccc4-5)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)cc1
InChIInChI=1S/C52H32N2.C48H30N2.C46H28N2/c1-2-14-35(15-3-1)53-47-24-12-10-19-39(47)42-28-26-34(31-50(42)53)33-27-29-49-45(30-33)41-21-11-13-25-48(41)54(49)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-43(37)52(46)44-23-9-7-20-40(44)51;1-2-12-33(13-3-1)49-45-20-10-8-18-40(45)42-25-22-32(29-48(42)49)31-23-27-47-44(28-31)41-19-9-11-21-46(41)50(47)34-24-26-39-37-16-5-4-14-35(37)36-15-6-7-17-38(36)43(39)30-34;1-2-11-31(12-3-1)47-41-19-8-6-15-34(41)36-23-21-30(28-45(36)47)29-22-25-44-40(27-29)35-16-7-9-20-42(35)48(44)43-26-24-38-33-14-5-4-13-32(33)37-17-10-18-39(43)46(37)38/h1-32H;1-30H;1-28H
InChIKeyUCWGJPSTLKGSHY-UHFFFAOYSA-N
MW1928.37 g/mol
LogP39.52
Rot. Bonds9

About 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole

2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole (PubChem CID 161056852) has the molecular formula C146H90N6 and a molecular weight of 1928.37 g/mol. Its IUPAC name is 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole.

Molecular Properties

Compound Name2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole
PubChem CID161056852
Molecular FormulaC146H90N6
Molecular Weight1928.37 g/mol
Exact Mass1926.72
IUPAC Name2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6c(cccc46)-c4ccccc4-5)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)cc1
InChIInChI=1S/C52H32N2.C48H30N2.C46H28N2/c1-2-14-35(15-3-1)53-47-24-12-10-19-39(47)42-28-26-34(31-50(42)53)33-27-29-49-45(30-33)41-21-11-13-25-48(41)54(49)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-43(37)52(46)44-23-9-7-20-40(44)51;1-2-12-33(13-3-1)49-45-20-10-8-18-40(45)42-25-22-32(29-48(42)49)31-23-27-47-44(28-31)41-19-9-11-21-46(41)50(47)34-24-26-39-37-16-5-4-14-35(37)36-15-6-7-17-38(36)43(39)30-34;1-2-11-31(12-3-1)47-41-19-8-6-15-34(41)36-23-21-30(28-45(36)47)29-22-25-44-40(27-29)35-16-7-9-20-42(35)48(44)43-26-24-38-33-14-5-4-13-32(33)37-17-10-18-39(43)46(37)38/h1-32H;1-30H;1-28H
InChIKeyUCWGJPSTLKGSHY-UHFFFAOYSA-N
XLogP39.52
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms152
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001928.37
LogP ≤ 539.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 160826915
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 71291323
3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole
CID 160959473
3-[9-(4-fluoranthen-3-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 71291329
3-[9-[4-(7,7-dimethylbenzo[g]fluoren-9-yl)naphthalen-1-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[6-(7,7-dimethylbenzo[g]fluoren-9-yl)naphthalen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[7-(7,7-dimethylbenzo[g]fluoren-9-yl)naphthalen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-2-yl)-9-phenylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-2-yl]-9-phenylcarbazole;2-(9-phenylcarbazol-3-yl)-9-triphenylen-2-ylcarbazole
CID 158425403
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-(9-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-phenylcarbazole
CID 161134789
6-[9-(4-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-1-yl)carbazol-3-yl]-2-[9-(6-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420634
2-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-fluoranthen-3-ylcarbazole
CID 70658954
3-[9-(7-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-fluoranthen-3-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-triphenylen-2-ylnaphthalen-1-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(6-triphenylen-2-ylnaphthalen-2-yl)carbazole
CID 158215347
2-(9-phenylcarbazol-3-yl)-6-[21-[4-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8(13),9,11,15,17,19,21-undecaenyl]-9-(4-triphenylen-2-ylphenyl)carbazole
CID 163802798
6-[9-(4-fluoranthen-3-ylphenyl)carbazol-3-yl]-2-[9-(3-fluoranthen-3-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420632
2-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-fluoranthen-3-ylcarbazole;2-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;2-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(4-triphenylen-2-ylphenyl)carbazole
CID 159490163

Frequently Asked Questions

What is the IUPAC name of 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole?
The IUPAC name of 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole (CID 161056852) is 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole.
What is the SMILES notation for 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole?
The canonical SMILES for 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole is c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6c(cccc46)-c4ccccc4-5)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)cc32)cc1.
What is the InChIKey of 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole?
The InChIKey is UCWGJPSTLKGSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N2.C48H30N2.C46H28N2/c1-2-14-35(15-3-1)53-47-24-12-10-19-39(47)42-28-26-34(31-50(42)53)33-27-29-49-45(30-33)41-21-11-13-25-48(41)54(49)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-43(37)52(46)44-23-9-7-20-40(44)51;1-2-12-33(13-3-1)49-45-20-10-8-18-40(45)42-25-22-32(29-48(42)49)31-23-27-47-44(28-31)41-19-9-11-21-46(41)50(47)34-24-26-39-37-16-5-4-14-35(37)36-15-6-7-17-38(36)43(39)30-34;1-2-11-31(12-3-1)47-41-19-8-6-15-34(41)36-23-21-30(28-45(36)47)29-22-25-44-40(27-29)35-16-7-9-20-42(35)48(44)43-26-24-38-33-14-5-4-13-32(33)37-17-10-18-39(43)46(37)38/h1-32H;1-30H;1-28H.
What are the key properties of 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole?
2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole has a molecular weight of 1928.37 g/mol, XLogP of 39.52, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole is sourced from PubChem (CID 161056852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).