CAS Registry Number: 89895-55-6
(Component: 50585-89-2)

Name:

3-​Piperidinecarboxylic acid, methyl ester, hydrochloride (1:1)
3-​Piperidinecarboxylic acid, methyl ester, hydrochloride (9CI); Nipecotic acid, methyl ester, hydrochloride (7CI); Methyl 3-​piperidinecarboxylat​e hydrochloride; Methyl nipecotate hydrochloride 

Deleted CAS Registry Numbers: 159923-​24-​7

Chemical Formula: C7H14ClNO2
Exact Mass: 179.07
Molecular Weight: 179.64
m/z: 179.07 (100.0%), 181.07 (32.0%), 180.07 (7.9%), 182.07 (2.6%)
Elemental Analysis: C, 46.80; H, 7.86; Cl, 19.74; N, 7.80; O, 17.81

InChI: InChI=1S/C7H13NO2.ClH/c1-10-7(9)6-3-2-4-8-5-6;/h6,8H,2-5H2,1H3;1H
InChIKey: BQQZKNAQDKIGGZ-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1CCCNC1.Cl

Specification

98%

PCT Int. Appl. (2013), WO 2013025425 A1 20130221. 

PCT Int. Appl. (2000), WO 2000069810 A1 20001123.