9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole

C39H29N — CID 166037340

IUPAC9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1ccccc1-c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C39H29N/c1-25-15-19-38-35(21-25)36-22-26(2)16-20-39(36)40(38)37-14-8-7-13-34(37)33-12-6-5-11-31(33)28-17-18-32-29(24-28)23-27-9-3-4-10-30(27)32/h3-22,24H,23H2,1-2H3
InChIKeyQTUKUBBJMJSVIH-UHFFFAOYSA-N
MW511.67 g/mol
LogP10.31
Rot. Bonds3

About 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole

9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole (PubChem CID 166037340) has the molecular formula C39H29N and a molecular weight of 511.67 g/mol. Its IUPAC name is 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole.

Molecular Properties

Compound Name9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole
PubChem CID166037340
Molecular FormulaC39H29N
Molecular Weight511.67 g/mol
Exact Mass511.23
IUPAC Name9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1ccccc1-c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C39H29N/c1-25-15-19-38-35(21-25)36-22-26(2)16-20-39(36)40(38)37-14-8-7-13-34(37)33-12-6-5-11-31(33)28-17-18-32-29(24-28)23-27-9-3-4-10-30(27)32/h3-22,24H,23H2,1-2H3
InChIKeyQTUKUBBJMJSVIH-UHFFFAOYSA-N
XLogP10.31
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.67
LogP ≤ 510.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[2-(9H-fluoren-3-yl)phenyl]carbazole
CID 157409452
3,6-dimethyl-9-[2-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170060425
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
CID 170201849
9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole
CID 71062116
9-[4-(9H-fluoren-3-yl)phenyl]-3-methyl-6-(trifluoromethyl)carbazole
CID 159939100
3-[9-[3-(9H-fluoren-2-yl)naphthalen-1-yl]carbazol-3-yl]-9-phenylcarbazole
CID 126753402
3-(3,5-dimethylphenyl)-9-(9H-fluoren-4-yl)carbazole
CID 118504532
9-(9H-fluoren-3-yl)-14-(4-methylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 163468224
trimethyl-[2-methyl-8-(5-trimethylsilyl-6H-indeno[2,1-b]indol-3-yl)-6H-indeno[2,1-b]indol-5-yl]silane
CID 153260789
3-[9-[2-(9H-fluoren-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 126753267
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
9H-fluorene;9-methyltetracyclo[6.5.0.04,12.05,10]trideca-1(13),2,4(12),5(10),6,8-hexaene
CID 173160450

Frequently Asked Questions

What is the IUPAC name of 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole?
The IUPAC name of 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole (CID 166037340) is 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole.
What is the SMILES notation for 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole?
The canonical SMILES for 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccccc1-c1ccccc1-c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole?
The InChIKey is QTUKUBBJMJSVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H29N/c1-25-15-19-38-35(21-25)36-22-26(2)16-20-39(36)40(38)37-14-8-7-13-34(37)33-12-6-5-11-31(33)28-17-18-32-29(24-28)23-27-9-3-4-10-30(27)32/h3-22,24H,23H2,1-2H3.
What are the key properties of 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole?
9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole has a molecular weight of 511.67 g/mol, XLogP of 10.31, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[2-(9H-fluoren-2-yl)phenyl]phenyl]-3,6-dimethylcarbazole is sourced from PubChem (CID 166037340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).