9-(4-bromophenyl)-2-tert-butylcarbazole

C22H20BrN — CID 142745661

IUPAC9-(4-bromophenyl)-2-tert-butylcarbazole
SMILESCC(C)(C)c1ccc2c3ccccc3n(-c3ccc(Br)cc3)c2c1
InChIInChI=1S/C22H20BrN/c1-22(2,3)15-8-13-19-18-6-4-5-7-20(18)24(21(19)14-15)17-11-9-16(23)10-12-17/h4-14H,1-3H3
InChIKeySWWJKESPXRJECG-UHFFFAOYSA-N
MW378.31 g/mol
LogP6.84
Rot. Bonds1

About 9-(4-bromophenyl)-2-tert-butylcarbazole

9-(4-bromophenyl)-2-tert-butylcarbazole (PubChem CID 142745661) has the molecular formula C22H20BrN and a molecular weight of 378.31 g/mol. Its IUPAC name is 9-(4-bromophenyl)-2-tert-butylcarbazole.

Molecular Properties

Compound Name9-(4-bromophenyl)-2-tert-butylcarbazole
PubChem CID142745661
Molecular FormulaC22H20BrN
Molecular Weight378.31 g/mol
Exact Mass377.08
IUPAC Name9-(4-bromophenyl)-2-tert-butylcarbazole
SMILESCC(C)(C)c1ccc2c3ccccc3n(-c3ccc(Br)cc3)c2c1
InChIInChI=1S/C22H20BrN/c1-22(2,3)15-8-13-19-18-6-4-5-7-20(18)24(21(19)14-15)17-11-9-16(23)10-12-17/h4-14H,1-3H3
InChIKeySWWJKESPXRJECG-UHFFFAOYSA-N
XLogP6.84
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.31
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-tert-butyl-9-(4-phenylphenyl)carbazole
CID 122692449
9-(4-bromophenyl)-3,6-ditert-butylcarbazole
CID 139082644
2,7-bis(3,6-ditert-butylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121355698
3-(3-tert-butylcarbazol-9-yl)-6-carbazol-9-yl-9-phenylcarbazole
CID 59399314
2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-(9-phenylcarbazol-3-yl)carbazole;9-(4-tert-butylphenyl)-3-carbazol-9-ylcarbazole;3-tert-butyl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 159742903
9-(3-tert-butylphenyl)-2-[9-(4-tert-butylphenyl)carbazol-2-yl]carbazole
CID 126685172
2,7-ditert-butyl-9-[7-tert-butyl-9-[4-[2-[4-[2-tert-butyl-6-(2,7-ditert-butylcarbazol-9-yl)carbazol-9-yl]phenyl]propan-2-yl]phenyl]carbazol-3-yl]carbazole
CID 176617143
2-bromo-9-(9-phenylcarbazol-2-yl)carbazole
CID 167514320
4-(4-bromophenyl)furo[3,4-b]indole
CID 142722869
2-tert-butyl-9-[3-[3-(2-tert-butylcarbazol-9-yl)-5-carbazol-9-ylphenyl]phenyl]carbazole
CID 59501634
9-[4-(2-tert-butyl-10-phenylanthracen-9-yl)phenyl]carbazole
CID 58991757
9-tert-butylcarbazole;2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;9-(3-tert-butylphenyl)carbazole
CID 160742117

Frequently Asked Questions

What is the IUPAC name of 9-(4-bromophenyl)-2-tert-butylcarbazole?
The IUPAC name of 9-(4-bromophenyl)-2-tert-butylcarbazole (CID 142745661) is 9-(4-bromophenyl)-2-tert-butylcarbazole.
What is the SMILES notation for 9-(4-bromophenyl)-2-tert-butylcarbazole?
The canonical SMILES for 9-(4-bromophenyl)-2-tert-butylcarbazole is CC(C)(C)c1ccc2c3ccccc3n(-c3ccc(Br)cc3)c2c1.
What is the InChIKey of 9-(4-bromophenyl)-2-tert-butylcarbazole?
The InChIKey is SWWJKESPXRJECG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20BrN/c1-22(2,3)15-8-13-19-18-6-4-5-7-20(18)24(21(19)14-15)17-11-9-16(23)10-12-17/h4-14H,1-3H3.
What are the key properties of 9-(4-bromophenyl)-2-tert-butylcarbazole?
9-(4-bromophenyl)-2-tert-butylcarbazole has a molecular weight of 378.31 g/mol, XLogP of 6.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-bromophenyl)-2-tert-butylcarbazole is sourced from PubChem (CID 142745661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).