11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole

C60H36N2 — CID 130304461

IUPAC11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccc6ccccc6c4n5-c4ccc5ccc(-c6ccc7c8c(cccc68)-c6ccccc6-7)cc5c4)cc32)cc1
InChIInChI=1S/C60H36N2/c1-2-12-43(13-3-1)61-56-20-9-8-17-49(56)50-28-25-40(36-58(50)61)39-26-32-57-55(35-39)54-29-24-38-11-4-5-14-46(38)60(54)62(57)44-27-23-37-21-22-41(33-42(37)34-44)45-30-31-53-48-16-7-6-15-47(48)52-19-10-18-51(45)59(52)53/h1-36H
InChIKeyQSFIETANVXJLOA-UHFFFAOYSA-N
MW784.96 g/mol
LogP16.32
Rot. Bonds4

About 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole

11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole (PubChem CID 130304461) has the molecular formula C60H36N2 and a molecular weight of 784.96 g/mol. Its IUPAC name is 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole.

Molecular Properties

Compound Name11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole
PubChem CID130304461
Molecular FormulaC60H36N2
Molecular Weight784.96 g/mol
Exact Mass784.29
IUPAC Name11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccc6ccccc6c4n5-c4ccc5ccc(-c6ccc7c8c(cccc68)-c6ccccc6-7)cc5c4)cc32)cc1
InChIInChI=1S/C60H36N2/c1-2-12-43(13-3-1)61-56-20-9-8-17-49(56)50-28-25-40(36-58(50)61)39-26-32-57-55(35-39)54-29-24-38-11-4-5-14-46(38)60(54)62(57)44-27-23-37-21-22-41(33-42(37)34-44)45-30-31-53-48-16-7-6-15-47(48)52-19-10-18-51(45)59(52)53/h1-36H
InChIKeyQSFIETANVXJLOA-UHFFFAOYSA-N
XLogP16.32
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500784.96
LogP ≤ 516.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;9-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 161262150
8-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-9-(9-phenylcarbazol-3-yl)benzo[a]carbazole;9-[9-(2-fluoranthen-3-ylphenyl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;9-[9-(2-fluoranthen-3-ylphenyl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;11-(2-fluoranthen-3-ylphenyl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(2-fluoranthen-3-ylphenyl)-9-(9-phenylcarbazol-2-yl)benzo[a]carbazole
CID 157293261
11-[3-(3-fluoranthen-3-ylphenyl)phenyl]-8-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 130304405
8-[9-[4-(3-fluoranthen-3-ylphenyl)phenyl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;9-[9-[2-(4-fluoranthen-3-ylphenyl)phenyl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-[2-(4-fluoranthen-3-ylphenyl)phenyl]-9-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-[4-(3-fluoranthen-3-ylphenyl)phenyl]-9-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 158028690
9-[9-[4-(2-fluoranthen-3-ylphenyl)phenyl]carbazol-2-yl]-11-phenylbenzo[a]carbazole
CID 130304406
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566
9-[9-(4-fluoranthen-8-ylphenyl)carbazol-3-yl]-11-phenylbenzo[a]carbazole
CID 130304356
8-(9-fluoranthen-8-ylcarbazol-3-yl)-11-phenylbenzo[a]carbazole
CID 130304370
9-[9-[3-(3-fluoranthen-8-ylphenyl)phenyl]carbazol-3-yl]-11-phenylbenzo[a]carbazole
CID 130304261
9-[9-(5-fluoranthen-8-ylnaphthalen-1-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;9-[9-(5-fluoranthen-8-ylnaphthalen-1-yl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;11-(5-fluoranthen-8-ylnaphthalen-1-yl)-9-(9-phenylcarbazol-2-yl)benzo[a]carbazole;8-[9-[4-(4-fluoranthen-8-ylphenyl)phenyl]carbazol-2-yl]-11-phenylbenzo[a]carbazole
CID 159232477
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
11-[3-(2-fluoranthen-8-ylphenyl)phenyl]-8-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 130304252

Frequently Asked Questions

What is the IUPAC name of 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole?
The IUPAC name of 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole (CID 130304461) is 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole.
What is the SMILES notation for 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole?
The canonical SMILES for 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole is c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccc6ccccc6c4n5-c4ccc5ccc(-c6ccc7c8c(cccc68)-c6ccccc6-7)cc5c4)cc32)cc1.
What is the InChIKey of 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole?
The InChIKey is QSFIETANVXJLOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H36N2/c1-2-12-43(13-3-1)61-56-20-9-8-17-49(56)50-28-25-40(36-58(50)61)39-26-32-57-55(35-39)54-29-24-38-11-4-5-14-46(38)60(54)62(57)44-27-23-37-21-22-41(33-42(37)34-44)45-30-31-53-48-16-7-6-15-47(48)52-19-10-18-51(45)59(52)53/h1-36H.
What are the key properties of 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole?
11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole has a molecular weight of 784.96 g/mol, XLogP of 16.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole is sourced from PubChem (CID 130304461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).