4-Quinazolinecarboxylic acid, 1,2-dihydro-2-oxo-, hydrate (1:1)

CAS Registry Number®

1609403-74-8
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CAS Name

4-Quinazolinecarboxylic acid, 1,2-dihydro-2-oxo-, hydrate (1:1)

Molecular Formula

C9H6N2O3.H2O

Cite this Page

4-Quinazolinecarboxylic acid, 1,2-dihydro-2-oxo-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1609403-74-8 (retrieved 2024-07-07) (CAS RN: 1609403-74-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6N2O3.H2O/c12-8(13)7-5-3-1-2-4-6(5)10-9(14)11-7;/h1-4H,(H,12,13)(H,10,11,14);1H2

InChIKey

InChIKey=NIHPJHDPVITDCH-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=2C(NC(=O)N1)=CC=CC2.O

Canonical SMILES

O=C1N=C(C(=O)O)C=2C=CC=CC2N1.O

Other Names for this Substance

  • 4-Quinazolinecarboxylic acid, 1,2-dihydro-2-oxo-, hydrate (1:1)