Structure

1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl-

CAS
953414-75-0
Catalog Number
ACM953414750
Category
Other Products
Molecular Formula
C13H9BrN2

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Specification

Synonyms
1H-Pyrrolo[2,3-b]pyridine, 5-bromo-2-phenyl-;5-Bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridine
What is the molecular formula of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The molecular formula is C13H9BrN2.

When was 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl created and modified?

It was created on 2008-01-14 and modified on 2023-12-30.

What is the IUPAC Name of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The IUPAC Name is 5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridine.

What is the InChIKey of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The InChIKey is QLKZJMXSXCDCCF-UHFFFAOYSA-N.

What is the Canonical SMILES of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The Canonical SMILES is C1=CC=C(C=C1)C2=CC3=CC(=CN=C3N2)Br.

What is the molecular weight of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The molecular weight is 273.13 g/mol.

What is the CAS number of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The CAS number is 953414-75-0.

What is the XLogP3-AA value of 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl?

The XLogP3-AA value is 3.7.

How many hydrogen bond donor counts does 1H-Pyrrolo[2,3-b]pyridine,5-bromo-2-phenyl have?

It has 1 hydrogen bond donor count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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