9-chloro-6-phenyl-11H-benzo[a]carbazole

C22H14ClN — CID 51357149

IUPAC9-chloro-6-phenyl-11H-benzo[a]carbazole
SMILESClc1ccc2c(c1)[nH]c1c3ccccc3cc(-c3ccccc3)c21
InChIInChI=1S/C22H14ClN/c23-16-10-11-18-20(13-16)24-22-17-9-5-4-8-15(17)12-19(21(18)22)14-6-2-1-3-7-14/h1-13,24H
InChIKeyJFZLXVWNIQGCCI-UHFFFAOYSA-N
MW327.81 g/mol
LogP6.79
Rot. Bonds1

About 9-chloro-6-phenyl-11H-benzo[a]carbazole

9-chloro-6-phenyl-11H-benzo[a]carbazole (PubChem CID 51357149) has the molecular formula C22H14ClN and a molecular weight of 327.81 g/mol. Its IUPAC name is 9-chloro-6-phenyl-11H-benzo[a]carbazole.

Molecular Properties

Compound Name9-chloro-6-phenyl-11H-benzo[a]carbazole
PubChem CID51357149
Molecular FormulaC22H14ClN
Molecular Weight327.81 g/mol
Exact Mass327.08
IUPAC Name9-chloro-6-phenyl-11H-benzo[a]carbazole
SMILESClc1ccc2c(c1)[nH]c1c3ccccc3cc(-c3ccccc3)c21
InChIInChI=1S/C22H14ClN/c23-16-10-11-18-20(13-16)24-22-17-9-5-4-8-15(17)12-19(21(18)22)14-6-2-1-3-7-14/h1-13,24H
InChIKeyJFZLXVWNIQGCCI-UHFFFAOYSA-N
XLogP6.79
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.81
LogP ≤ 56.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

3,21-diphenyl-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 10645762
7-chloro-1,3-diphenyl-9H-carbazole
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3-chloro-5,7-dihydroindolo[2,3-c]quinolin-6-one
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9-chloro-13-phenyl-11H-indolo[3,2-c]phenanthridine
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11,28-diphenyl-13,30-diazanonacyclo[17.15.1.12,14.03,12.04,9.020,29.021,26.031,35.018,36]hexatriaconta-1,3(12),4,6,8,10,14,16,18(36),19(35),20(29),21,23,25,27,31,33-heptadecaene
CID 142925774
7-chloro-4-methyl-1-phenyl-9H-pyrido[3,4-b]indole-3-carboxylic acid
CID 175119806
7-phenyl-11H-benzo[a]carbazole
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2-chloro-6,12-diphenylchrysene
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8-(3-chlorophenyl)-7H-benzo[c]carbazole
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7-chloro-1-phenyl-9H-pyrano[3,4-b]indol-3-one
CID 23003309
4,10-dichloro-17-(10-chloro-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8(13),9,11,15,17,19-decaen-5-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1,3,5,7,9,11,13,15(20),16,18-decaene
CID 135234567
18-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 90433283

Frequently Asked Questions

What is the IUPAC name of 9-chloro-6-phenyl-11H-benzo[a]carbazole?
The IUPAC name of 9-chloro-6-phenyl-11H-benzo[a]carbazole (CID 51357149) is 9-chloro-6-phenyl-11H-benzo[a]carbazole.
What is the SMILES notation for 9-chloro-6-phenyl-11H-benzo[a]carbazole?
The canonical SMILES for 9-chloro-6-phenyl-11H-benzo[a]carbazole is Clc1ccc2c(c1)[nH]c1c3ccccc3cc(-c3ccccc3)c21.
What is the InChIKey of 9-chloro-6-phenyl-11H-benzo[a]carbazole?
The InChIKey is JFZLXVWNIQGCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14ClN/c23-16-10-11-18-20(13-16)24-22-17-9-5-4-8-15(17)12-19(21(18)22)14-6-2-1-3-7-14/h1-13,24H.
What are the key properties of 9-chloro-6-phenyl-11H-benzo[a]carbazole?
9-chloro-6-phenyl-11H-benzo[a]carbazole has a molecular weight of 327.81 g/mol, XLogP of 6.79, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-6-phenyl-11H-benzo[a]carbazole is sourced from PubChem (CID 51357149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).