CAS Registry Number: 946-99-6

Name:

2-​Propenoic acid, 3-​[4-​(bromomethyl)​phenyl]​-​, methyl ester
Cinnamic acid, p-​(bromomethyl)​-​, methyl ester (7CI,​8CI); 3-​(4-​Bromomethylphenyl)​acrylic acid methyl ester; Methyl 4-​bromomethylcinnamate 

Chemical Formula: C11H11BrO2
Exact Mass: 253.99
Molecular Weight: 255.11
m/z: 253.99 (100.0%), 255.99 (97.3%), 255.00 (12.1%), 257.00 (11.8%), 256.00 (1.1%), 258.00 (1.0%)

InChI: InChI=1S/C11H11BrO2/c1-14-11(13)7-6-9-2-4-10(8-12)5-3-9/h2-7H,8H2,1H3/b7-6+
InChIKey: ZSRCGGBALFGALF-VOTSOKGWSA-N
Canonical SMILES : COC(=O)C=CC1=CC=C(C=C1)CBr
Isomeric SMILES: COC(=O)/C=C/C1=CC=C(C=C1)CBr

Specification

98%

1. (1) Wang, Jun-Yin; Yaoxue Xuebao 1964, V11(9), P591-5 CAPLUS