1H-Imidazole-5-carboxylic acid, 4-methyl-2-phenyl-, hydrate (1:1)

CAS Registry Number®

1559064-09-3
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CAS Name

1H-Imidazole-5-carboxylic acid, 4-methyl-2-phenyl-, hydrate (1:1)

Molecular Formula

C11H10N2O2.H2O

Cite this Page

1H-Imidazole-5-carboxylic acid, 4-methyl-2-phenyl-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1559064-09-3 (retrieved 2024-09-10) (CAS RN: 1559064-09-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H10N2O2.H2O/c1-7-9(11(14)15)13-10(12-7)8-5-3-2-4-6-8;/h2-6H,1H3,(H,12,13)(H,14,15);1H2

InChIKey

InChIKey=KJNXKRTWGLREGH-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1NC(=NC1C)C2=CC=CC=C2.O

Canonical SMILES

O=C(O)C=1NC(=NC1C)C=2C=CC=CC2.O

Other Names for this Substance

  • 1H-Imidazole-5-carboxylic acid, 4-methyl-2-phenyl-, hydrate (1:1)