CAS Registry Number: 33402-75-4

Name:

3-​Pyridinecarboxylic acid, 4-​methyl-​, methyl ester
Nicotinic acid, 4-​methyl-​, methyl ester (8CI); Methyl 4-​methyl-​3-​pyridinecarboxylate; Methyl 4-​methylnicotinate 

Chemical Formula: C8H9NO2
Exact Mass: 151.06
Molecular Weight: 151.16
m/z: 151.06 (100.0%), 152.07 (8.8%)
Elemental Analysis: C, 63.56; H, 6.00; N, 9.27; O, 21.17

InChI: InChI=1S/C8H9NO2/c1-6-3-4-9-5-7(6)8(10)11-2/h3-5H,1-2H3
InChIKey: XEXPJABJVHEOCX-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C=NC=C1)C(=O)OC

Specification

98%

1. (1) Webb, James L.; Journal of the American Chemical Society 1944, V66, P1456-9 CAPLUS
2. (2) Jokela, Reija; Magnetic Resonance in Chemistry 1992, V30(7), P681-683 CAPLUS