2-(4-Ethyl-4,5-dihydro-4-methyl-5-oxo-1H-imidazol-2-yl)-3-pyridinecarboxylic acid

CAS Registry Number®

81334-29-4
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CAS Name

2-(4-Ethyl-4,5-dihydro-4-methyl-5-oxo-1H-imidazol-2-yl)-3-pyridinecarboxylic acid

Molecular Formula

C12H13N3O3

Molecular Mass

247.25

Cite this Page

2-(4-Ethyl-4,5-dihydro-4-methyl-5-oxo-1H-imidazol-2-yl)-3-pyridinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81334-29-4 (retrieved 2024-09-16) (CAS RN: 81334-29-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    124-126 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H13N3O3/c1-3-12(2)11(18)14-9(15-12)8-7(10(16)17)5-4-6-13-8/h4-6H,3H2,1-2H3,(H,16,17)(H,14,15,18)

InChIKey

InChIKey=BXOKENWBKGSFEL-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(N=CC=C1)C=2NC(CC)(C)C(=O)N2

Canonical SMILES

O=C(O)C=1C=CC=NC1C2=NC(=O)C(N2)(C)CC

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 2-(4-ethyl-4,5-dihydro-4-methyl-5-oxo-1H-imidazol-2-yl)-
  • 2-(4-Ethyl-4,5-dihydro-4-methyl-5-oxo-1H-imidazol-2-yl)-3-pyridinecarboxylic acid
  • 2-(4-Ethyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyridine-3-carboxylic acid

Deleted or Replaced CAS Registry Numbers

108224-76-6