1-chloro-8,9-diphenylcarbazole

C24H16ClN — CID 146616822

IUPAC1-chloro-8,9-diphenylcarbazole
SMILESClc1cccc2c3cccc(-c4ccccc4)c3n(-c3ccccc3)c12
InChIInChI=1S/C24H16ClN/c25-22-16-8-15-21-20-14-7-13-19(17-9-3-1-4-10-17)23(20)26(24(21)22)18-11-5-2-6-12-18/h1-16H
InChIKeyXSMXWMFSNOATEN-UHFFFAOYSA-N
MW353.85 g/mol
LogP7.10
Rot. Bonds2

About 1-chloro-8,9-diphenylcarbazole

1-chloro-8,9-diphenylcarbazole (PubChem CID 146616822) has the molecular formula C24H16ClN and a molecular weight of 353.85 g/mol. Its IUPAC name is 1-chloro-8,9-diphenylcarbazole.

Molecular Properties

Compound Name1-chloro-8,9-diphenylcarbazole
PubChem CID146616822
Molecular FormulaC24H16ClN
Molecular Weight353.85 g/mol
Exact Mass353.10
IUPAC Name1-chloro-8,9-diphenylcarbazole
SMILESClc1cccc2c3cccc(-c4ccccc4)c3n(-c3ccccc3)c12
InChIInChI=1S/C24H16ClN/c25-22-16-8-15-21-20-14-7-13-19(17-9-3-1-4-10-17)23(20)26(24(21)22)18-11-5-2-6-12-18/h1-16H
InChIKeyXSMXWMFSNOATEN-UHFFFAOYSA-N
XLogP7.10
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.85
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-8,9-diphenylcarbazole?
The IUPAC name of 1-chloro-8,9-diphenylcarbazole (CID 146616822) is 1-chloro-8,9-diphenylcarbazole.
What is the SMILES notation for 1-chloro-8,9-diphenylcarbazole?
The canonical SMILES for 1-chloro-8,9-diphenylcarbazole is Clc1cccc2c3cccc(-c4ccccc4)c3n(-c3ccccc3)c12.
What is the InChIKey of 1-chloro-8,9-diphenylcarbazole?
The InChIKey is XSMXWMFSNOATEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClN/c25-22-16-8-15-21-20-14-7-13-19(17-9-3-1-4-10-17)23(20)26(24(21)22)18-11-5-2-6-12-18/h1-16H.
What are the key properties of 1-chloro-8,9-diphenylcarbazole?
1-chloro-8,9-diphenylcarbazole has a molecular weight of 353.85 g/mol, XLogP of 7.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-8,9-diphenylcarbazole is sourced from PubChem (CID 146616822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).