CAS Registry Number: 67858-47-3

Name:

1H-​Pyrrole-​2-​carboxylic acid, 4-​formyl-​1-​methyl-​, methyl ester
4-​Formyl-​1-​methyl-​1H-​pyrrole-​2-​carboxylic acid methyl ester; 5-​Methoxycarbonyl-​1-​methyl-​1H-​pyrrole-​3-​carboxaldehyde; Methyl 4-​formyl-​1-​methyl-​1H-​pyrrole-​2-​carboxylate 

Chemical Formula: C8H9NO3
Exact Mass: 167.06
Molecular Weight: 167.16
m/z: 167.06 (100.0%), 168.06 (9.2%)
Elemental Analysis: C, 57.48; H, 5.43; N, 8.38; O, 28.71

InChI: InChI=1S/C8H9NO3/c1-9-4-6(5-10)3-7(9)8(11)12-2/h3-5H,1-2H3
InChIKey: GXSZDESAIZEFGZ-UHFFFAOYSA-N
Canonical SMILES : CN1C=C(C=C1C(=O)OC)C=O

Specification

98%

1. (1) Barker, Peter; Journal of Organic Chemistry 1978, V43(25), P4849-53 CAPLUS