CAS Registry Number: 103565-40-8
(Component: 100511-78-2)

Name:

Benzenepropanoic acid, 4-​(aminomethyl)​-​, methyl ester, hydrochloride (1:1)
Benzenepropanoic acid, 4-​(aminomethyl)​-​, methyl ester, hydrochloride (9CI); Hydrocinnamic acid, p-​(aminomethyl)​-​, methyl ester, hydrochloride (6CI); 4-​(Aminomethyl)​benzenepropanoic acid methyl ester hydrochloride; Methyl 3-​[4-​(aminomethyl)​phenyl]​propionate hydrochloride 

Chemical Formula: C11H16ClNO2
Exact Mass: 229.09
Molecular Weight: 229.70
m/z: 229.09 (100.0%), 231.08 (32.0%), 230.09 (12.2%), 232.09 (3.9%), 231.09 (1.1%)
Elemental Analysis: C, 57.52; H, 7.02; Cl, 15.43; N, 6.10; O, 13.93

InChI: InChI=1S/C11H15NO2.ClH/c1-14-11(13)7-6-9-2-4-10(8-12)5-3-9;/h2-5H,6-8,12H2,1H3;1H
InChIKey: DPQPQVOUGGBIGS-UHFFFAOYSA-N
Canonical SMILES : COC(=O)CCC1=CC=C(C=C1)CN.Cl

Specification

98%

PCT Int. Appl. (2004), WO 2004012731 A1 20040212.                                 

PCT Int. Appl. (2002), WO 2002102771 A1 20021227.