2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole

C37H24BrN — CID 167214778

IUPAC2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole
SMILESBrc1ccc2c3cc(C4(c5ccccc5)c5ccccc5-c5ccccc54)ccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C37H24BrN/c38-27-20-21-31-32-23-26(19-22-35(32)39(36(31)24-27)28-13-5-2-6-14-28)37(25-11-3-1-4-12-25)33-17-9-7-15-29(33)30-16-8-10-18-34(30)37/h1-24H
InChIKeyJETPRQMVJNLRPM-UHFFFAOYSA-N
MW562.51 g/mol
LogP9.91
Rot. Bonds3

About 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole

2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole (PubChem CID 167214778) has the molecular formula C37H24BrN and a molecular weight of 562.51 g/mol. Its IUPAC name is 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole.

Molecular Properties

Compound Name2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole
PubChem CID167214778
Molecular FormulaC37H24BrN
Molecular Weight562.51 g/mol
Exact Mass561.11
IUPAC Name2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole
SMILESBrc1ccc2c3cc(C4(c5ccccc5)c5ccccc5-c5ccccc54)ccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C37H24BrN/c38-27-20-21-31-32-23-26(19-22-35(32)39(36(31)24-27)28-13-5-2-6-14-28)37(25-11-3-1-4-12-25)33-17-9-7-15-29(33)30-16-8-10-18-34(30)37/h1-24H
InChIKeyJETPRQMVJNLRPM-UHFFFAOYSA-N
XLogP9.91
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.51
LogP ≤ 59.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[2,7-dibromo-9-(9-phenylcarbazol-3-yl)fluoren-9-yl]-9-phenylcarbazole
CID 102125302
9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
CID 118145084
2-[2,7-dibromo-9-(9-phenylcarbazol-2-yl)fluoren-9-yl]-9-phenylcarbazole
CID 174722442
2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
CID 90216123
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
9-phenyl-7-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)carbazol-3-amine
CID 167334078
N-(9,9-diphenylfluoren-2-yl)-9-phenyl-6-(9-phenylfluoren-9-yl)-N-triphenylen-2-ylcarbazol-3-amine
CID 167334144
3-carbazol-9-yl-9-(9-phenylcarbazol-4-yl)-6-(9-phenylfluoren-9-yl)carbazole
CID 167052712
methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 158348177
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[9-[4-(2-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]carbazole
CID 154590784
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[9-[4-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590519
9-phenyl-3-(9-phenylxanthen-9-yl)carbazole
CID 134164714

Frequently Asked Questions

What is the IUPAC name of 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole?
The IUPAC name of 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole (CID 167214778) is 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole.
What is the SMILES notation for 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole?
The canonical SMILES for 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole is Brc1ccc2c3cc(C4(c5ccccc5)c5ccccc5-c5ccccc54)ccc3n(-c3ccccc3)c2c1.
What is the InChIKey of 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole?
The InChIKey is JETPRQMVJNLRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24BrN/c38-27-20-21-31-32-23-26(19-22-35(32)39(36(31)24-27)28-13-5-2-6-14-28)37(25-11-3-1-4-12-25)33-17-9-7-15-29(33)30-16-8-10-18-34(30)37/h1-24H.
What are the key properties of 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole?
2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole has a molecular weight of 562.51 g/mol, XLogP of 9.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole is sourced from PubChem (CID 167214778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).