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Substance Name: Acetylurea
RN: 591-07-1
UNII: 8KRU31I919
InChIKey: GKRZNOGGALENQJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C3-H6-N2-O2

Molecular Weight

  • 102.092
 
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Names and Synonyms

Name of Substance

  • Acetylurea

Synonyms

  • 1-Acetylurea
  • 3-03-00-00119 (Beilstein Handbook Reference)
  • Acetic acid, ureide
  • Acetylcarbamide
  • Acetylurea
  • AI3-03704
  • BRN 1751301
  • EINECS 209-698-3
  • Monoacetylurea
  • N-(Aminocarbonyl)acetamide
  • N-Acetylurea
  • NSC 2766
  • UNII-8KRU31I919

Systematic Names

  • Acetamide, N-(aminocarbonyl)-
  • Acetylurea
  • Urea, acetyl- (6CI,7CI,8CI)

Registry Numbers

CAS Registry Number

  • 591-07-1

FDA UNII

  • 8KRU31I919

System Generated Number

  • 0000591071

Structure Descriptors

InChI

1S/C3H6N2O2/c1-2(6)5-3(4)7/h1H3,(H3,4,5,6,7)

InChIKey

GKRZNOGGALENQJ-UHFFFAOYSA-N

Smiles

O=C(NC(=O)C)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   National Technical Information Service. Vol. AD691-490,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 218 deg C   EXP
log P (octanol-water) -1.010 (none)   EST
Water Solubility 1.30E+04 mg/L 15 EXP
Atmospheric OH Rate Constant 2.10E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.