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Substance Name: 1,2,4-Benzenetricarboxylic acid, compd. with 2-phenyl-1H-imidazole-1-propanenitrile (1:1)
RN: 68083-35-2
InChIKey: QJSQHECLPTYPNR-UHFFFAOYSA-N

Molecular Formula

  • C12-H11-N3.C9-H6-O6

Molecular Weight

  • 407.38
 
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Names and Synonyms

Synonyms

  • 1-Cyanoethyl-2-phenylimidazoletrimellitate (1:1)
  • EINECS 268-383-9
  • Trimellitic acid 1-cyanoethyl-2-phenylimidazole salt (1:1)

Systematic Names

  • 1,2,4-Benzenetricarboxylic acid, compd. with 2-phenyl-1H-imidazole-1-propanenitrile (1:1)
  • Benzene-1,2,4-tricarboxylic acid, compound with 2-phenyl-1H-imidazole-1-propiononitrile (1:1)

Registry Numbers

CAS Registry Number

  • 68083-35-2

Other Registry Numbers

  • 137472-68-5
  • 145150-84-1
  • 87940-38-3

System Generated Number

  • 0068083352

Molecular Formulas

Molecular Formula

  • C12-H11-N3.C9-H6-O6

Molecular Formula Fragments

  • C12-H11-N3
  • C9-H6-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C12H11N3.C9H6O6/c13-7-4-9-15-10-8-14-12(15)11-5-2-1-3-6-11;10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3,5-6,8,10H,4,9H2;1-3H,(H,10,11)(H,12,13)(H,14,15)

InChIKey

QJSQHECLPTYPNR-UHFFFAOYSA-N

Smiles

n1(c(c2ccccc2)ncc1)CCC#N.c1c(cc(cc1C(=O)O)C(=O)O)C(=O)O