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CAS Number: 58954-23-7
2-propyl-1H-imidazole-4,5-dicarboxylic acid

Structure

 2-propyl-1H-imidazole-4,5-dicarboxylic acid
Name: 2-propyl-1H-imidazole-4,5-dicarboxylic acid
Synonyms:
General Information
Product Number: 58954237

CAS Registry Number 58954-23-7
Name:
1H-?Imidazole-?4,?5-?dicarboxylic acid, 2-?propyl-
Imidazole-4,5-dicarboxylic acid, 2-propyl- (6CI)
2-Propyl-1H-imidazole-4,5-dicarboxylic acid
2-Propyl-4,5-imidazoledicarboxylic acid
IEM 1795

 

Chemical Formula: C8H10N2O4
Exact Mass: 198.06
Molecular Weight: 198.18
m/z: 198.06 (100.0%), 199.07 (8.9%), 200.07 (1.2%)

 

InChI:InChI=1S/C8H10N2O4/c1-2-3-4-9-5(7(11)12)6(10-4)8(13)14/h2-3H2,1H3,(H,9,10)(H,11,12)(H,13,14)

InChI Key:BGPZYJSOTDBJMV-UHFFFAOYSA-N

Canonical SMILES:CCCC1=NC(=C(N1)C(=O)O)C(=O)O

Specification

98%
References
  1. (3) Li, Shi Jie; Acta Crystallographica, Section E: Structure Reports Online 2010, V66(9), Pm1094-m1095 CAPLUS
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