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

C144H88N6 — CID 161134789

IUPAC3-(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
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccccc5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)-c4cc6ccccc6c6cccc-5c46)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13
InChIInChI=1S/2C50H30N2.C44H28N2/c1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-12-34(13-3-1)51-46-19-8-6-15-38(46)43-27-31(21-25-48(43)51)32-22-26-49-44(28-32)39-16-7-9-20-47(39)52(49)35-23-24-37-41-18-10-17-40-36-14-5-4-11-33(36)29-45(50(40)41)42(37)30-35;1-2-13-32(14-3-1)45-40-20-10-8-18-36(40)38-26-29(22-24-42(38)45)30-23-25-43-39(27-30)37-19-9-11-21-41(37)46(43)44-28-31-12-4-5-15-33(31)34-16-6-7-17-35(34)44/h2*1-30H;1-28H
InChIKeyUMQNSZWVGOEDKK-UHFFFAOYSA-N
MW1902.33 g/mol
LogP38.86
Rot. Bonds9

About 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

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 (PubChem CID 161134789) has the molecular formula C144H88N6 and a molecular weight of 1902.33 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name3-(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
PubChem CID161134789
Molecular FormulaC144H88N6
Molecular Weight1902.33 g/mol
Exact Mass1900.71
IUPAC Name3-(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
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccccc5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)-c4cc6ccccc6c6cccc-5c46)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13
InChIInChI=1S/2C50H30N2.C44H28N2/c1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-12-34(13-3-1)51-46-19-8-6-15-38(46)43-27-31(21-25-48(43)51)32-22-26-49-44(28-32)39-16-7-9-20-47(39)52(49)35-23-24-37-41-18-10-17-40-36-14-5-4-11-33(36)29-45(50(40)41)42(37)30-35;1-2-13-32(14-3-1)45-40-20-10-8-18-36(40)38-26-29(22-24-42(38)45)30-23-25-43-39(27-30)37-19-9-11-21-41(37)46(43)44-28-31-12-4-5-15-33(31)34-16-6-7-17-35(34)44/h2*1-30H;1-28H
InChIKeyUMQNSZWVGOEDKK-UHFFFAOYSA-N
XLogP38.86
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms150
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001902.33
LogP ≤ 538.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Related Compounds

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;3-[9-(3-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-ylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 159993956
methane;3-(9-naphthalen-1-ylcarbazol-3-yl)-9-phenanthren-9-ylcarbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenanthren-9-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-7-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;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-(3-phenylphenyl)carbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 158898866
3-(9-naphthalen-1-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 158986267
3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-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-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 158707626
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
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 71291323
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
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
3-[9-[3-(12-hexacyclo[12.12.0.02,11.03,8.015,20.021,26]hexacosa-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaenyl)phenyl]carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-[4-(12-hexacyclo[12.12.0.02,11.03,8.015,20.021,26]hexacosa-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaenyl)phenyl]carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-(9-naphthalen-1-ylcarbazol-3-yl)-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-ylphenyl)carbazole
CID 159504856
3-(9-chrysen-2-ylcarbazol-2-yl)-9-phenylcarbazole;3-[9-(4-fluoranthen-3-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(12-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1,3,5,7,9,11,13,15,17,19,21-undecaenyl)carbazol-2-yl]-9-phenylcarbazole
CID 161046718
3-[9-(4-fluoranthen-3-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 71291329

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccccc5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)-c4cc6ccccc6c6cccc-5c46)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13.
What is the InChIKey of 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?
The InChIKey is UMQNSZWVGOEDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C50H30N2.C44H28N2/c1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-12-34(13-3-1)51-46-19-8-6-15-38(46)43-27-31(21-25-48(43)51)32-22-26-49-44(28-32)39-16-7-9-20-47(39)52(49)35-23-24-37-41-18-10-17-40-36-14-5-4-11-33(36)29-45(50(40)41)42(37)30-35;1-2-13-32(14-3-1)45-40-20-10-8-18-36(40)38-26-29(22-24-42(38)45)30-23-25-43-39(27-30)37-19-9-11-21-41(37)46(43)44-28-31-12-4-5-15-33(31)34-16-6-7-17-35(34)44/h2*1-30H;1-28H.
What are the key properties of 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?
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 has a molecular weight of 1902.33 g/mol, XLogP of 38.86, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 161134789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).