2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(4-hydroxyphenyl)-, hydrate (1:1)

CAS Registry Number®

80866-89-3

CAS Name

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(4-hydroxyphenyl)-, hydrate (1:1)

Molecular Formula

C12H12N2O4.H2O

Cite this Page

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(4-hydroxyphenyl)-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80866-89-3 (retrieved 2024-12-19) (CAS RN: 80866-89-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    232-233 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12N2O4.H2O/c1-2-12(7-3-5-8(15)6-4-7)9(16)13-11(18)14-10(12)17;/h3-6,15H,2H2,1H3,(H2,13,14,16,17,18);1H2

InChIKey

InChIKey=MBYACWAYRFZUSS-UHFFFAOYSA-N

SMILES

C(C)C1(C(=O)NC(=O)NC1=O)C2=CC=C(O)C=C2.O

Canonical SMILES

O=C1NC(=O)C(C(=O)N1)(C2=CC=C(O)C=C2)CC.O

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(4-hydroxyphenyl)-, hydrate (1:1)
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(4-hydroxyphenyl)-, monohydrate

CAS INSIGHTSTM
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