2-chloro-9H-carbazole

C12H8ClN — CID 2752388

IUPAC2-chloro-9H-carbazole
SMILESClc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H8ClN/c13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8/h1-7,14H
InChIKeyLOQQFCPPDBFFSO-UHFFFAOYSA-N
MW201.66 g/mol
LogP3.97
Rot. Bonds

About 2-chloro-9H-carbazole

2-chloro-9H-carbazole (PubChem CID 2752388) has the molecular formula C12H8ClN and a molecular weight of 201.66 g/mol. Its IUPAC name is 2-chloro-9H-carbazole.

Molecular Properties

Compound Name2-chloro-9H-carbazole
PubChem CID2752388
Molecular FormulaC12H8ClN
Molecular Weight201.66 g/mol
Exact Mass201.03
IUPAC Name2-chloro-9H-carbazole
SMILESClc1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H8ClN/c13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8/h1-7,14H
InChIKeyLOQQFCPPDBFFSO-UHFFFAOYSA-N
XLogP3.97
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.66
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-9H-carbazole?
The IUPAC name of 2-chloro-9H-carbazole (CID 2752388) is 2-chloro-9H-carbazole.
What is the SMILES notation for 2-chloro-9H-carbazole?
The canonical SMILES for 2-chloro-9H-carbazole is Clc1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-chloro-9H-carbazole?
The InChIKey is LOQQFCPPDBFFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN/c13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8/h1-7,14H.
What are the key properties of 2-chloro-9H-carbazole?
2-chloro-9H-carbazole has a molecular weight of 201.66 g/mol, XLogP of 3.97, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-9H-carbazole is sourced from PubChem (CID 2752388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).