4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, hydrate (1:1)

CAS Registry Number®

50887-69-9

CAS Name

4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, hydrate (1:1)

Molecular Formula

C5H4N2O4.H2O

Cite this Page

4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=50887-69-9 (retrieved 2024-12-23) (CAS RN: 50887-69-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    334 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C5H4N2O4.H2O/c8-3-1-2(4(9)10)6-5(11)7-3;/h1H,(H,9,10)(H2,6,7,8,11);1H2

InChIKey

InChIKey=YXUZGLGRBBHYFZ-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(=O)NC(=O)N1.O

Canonical SMILES

O=C1C=C(NC(=O)N1)C(=O)O.O

Other Names for this Substance

  • 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, hydrate (1:1)
  • 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, monohydrate
  • Orotic acid monohydrate
  • 2,6-Dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid hydrate
  • 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid hydrate

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