CAS Registry Number: 14731-14-7
Name:

2-bromo-1-(3-phenylisoxazol-5-yl)ethanone

5-(Bromoacetyl)-3-phenylisoxazole

Chemical Formula: C11H8BrNO2
Exact Mass: 264.97
Molecular Weight: 266.09
m/z: 264.97 (100.0%), 266.97 (97.3%), 265.98 (12.1%), 267.98 (11.8%), 266.98 (1.1%), 268.98 (1.0%)

InChI
InChI=1S/C11H8BrNO2/c12-7-10(14)11-6-9(13-15-11)8-4-2-1-3-5-8/h1-6H,7H2
InChI Key
XTBXGZOVSCTNEC-UHFFFAOYSA-N
Canonical SMILES
C1=CC=C(C=C1)C2=NOC(=C2)C(=O)CBr

Specification

98%

Bioorganic & Medicinal Chemistry (1999), 7(11), 2607-2613.

Eur. Pat. Appl. (1990), EP 399645 A2 19901128.