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Substance Name: Allylurea
RN: 557-11-9
UNII: 0CZM19WLK8
InChIKey: VPJDULFXCAQHRC-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Experimental Pesticide
  • Mutation Data
  • Unspecified / Unclassified Pesticide

Molecular Formula

  • C4-H8-N2-O

Molecular Weight

  • 100.1202
 
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Names and Synonyms

Name of Substance

  • 2-Propenylurea
  • Allylurea

Synonyms

  • 1-Allylurea
  • 2-Propenylurea
  • 4-04-00-01070 (Beilstein Handbook Reference)
  • AI3-23204
  • Allyl urea
  • Allylcarbamide
  • Allylurea
  • BRN 1745068
  • CCRIS 5958
  • EINECS 209-157-1
  • Monoallylurea
  • N-2-Propenylurea
  • N-Allylurea
  • NSC 7607
  • UNII-0CZM19WLK8

Systematic Names

  • Allylurea
  • Urea, 2-propenyl-
  • Urea, allyl-
  • Urea, N-2-propen-1-yl-

Registry Numbers

CAS Registry Number

  • 557-11-9

FDA UNII

  • 0CZM19WLK8

System Generated Number

  • 0000557119

Structure Descriptors

InChI

1S/C4H8N2O/c1-2-3-6-4(5)7/h2H,1,3H2,(H3,5,6,7)

InChIKey

VPJDULFXCAQHRC-UHFFFAOYSA-N

Smiles

N(C(N)=O)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 1070mg/kg (1070mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 14, Pg. 111, 1985.
rat LDLo oral 250mg/kg (250mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 47, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 85 deg C   EXP
log P (octanol-water) -0.240 (none)   EST
Atmospheric OH Rate Constant 3.21E-11 cm3/molecule-sec 25 EST

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