5-bromo-3-chloro-9H-carbazole

C12H7BrClN — CID 156561509

IUPAC5-bromo-3-chloro-9H-carbazole
SMILESClc1ccc2[nH]c3cccc(Br)c3c2c1
InChIInChI=1S/C12H7BrClN/c13-9-2-1-3-11-12(9)8-6-7(14)4-5-10(8)15-11/h1-6,15H
InChIKeyOAWSZHRGZWATEK-UHFFFAOYSA-N
MW280.55 g/mol
LogP4.74
Rot. Bonds

About 5-bromo-3-chloro-9H-carbazole

5-bromo-3-chloro-9H-carbazole (PubChem CID 156561509) has the molecular formula C12H7BrClN and a molecular weight of 280.55 g/mol. Its IUPAC name is 5-bromo-3-chloro-9H-carbazole.

Molecular Properties

Compound Name5-bromo-3-chloro-9H-carbazole
PubChem CID156561509
Molecular FormulaC12H7BrClN
Molecular Weight280.55 g/mol
Exact Mass278.95
IUPAC Name5-bromo-3-chloro-9H-carbazole
SMILESClc1ccc2[nH]c3cccc(Br)c3c2c1
InChIInChI=1S/C12H7BrClN/c13-9-2-1-3-11-12(9)8-6-7(14)4-5-10(8)15-11/h1-6,15H
InChIKeyOAWSZHRGZWATEK-UHFFFAOYSA-N
XLogP4.74
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.55
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-9H-carbazole?
The IUPAC name of 5-bromo-3-chloro-9H-carbazole (CID 156561509) is 5-bromo-3-chloro-9H-carbazole.
What is the SMILES notation for 5-bromo-3-chloro-9H-carbazole?
The canonical SMILES for 5-bromo-3-chloro-9H-carbazole is Clc1ccc2[nH]c3cccc(Br)c3c2c1.
What is the InChIKey of 5-bromo-3-chloro-9H-carbazole?
The InChIKey is OAWSZHRGZWATEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrClN/c13-9-2-1-3-11-12(9)8-6-7(14)4-5-10(8)15-11/h1-6,15H.
What are the key properties of 5-bromo-3-chloro-9H-carbazole?
5-bromo-3-chloro-9H-carbazole has a molecular weight of 280.55 g/mol, XLogP of 4.74, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-9H-carbazole is sourced from PubChem (CID 156561509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).