874-74-8 Purity
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Specification
The molecular formula is C9H7BrN2.
The compound was first created on July 19, 2005, and last modified on December 30, 2023.
The IUPAC name is 1-(2-bromophenyl)pyrazole.
The InChI is InChI=1S/C9H7BrN2/c10-8-4-1-2-5-9(8)12-7-3-6-11-12/h1-7H.
The InChIKey is QNDJHGODPWAKAO-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC=C(C(=C1)N2C=CC=N2)Br.
The CAS number is 87488-84-4.
The molecular weight is 223.07 g/mol.
It has one hydrogen bond acceptor.
Yes, the compound is canonicalized.