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Substance Name: Benzylurea
RN: 538-32-9
UNII: 0K14I09J76
InChIKey: RJNJWHFSKNJCTB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H10-N2-O

Molecular Weight

  • 150.18
 
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Names and Synonyms

Name of Substance

  • Benzylurea

Synonyms

  • 1-Benzylurea
  • 4-12-00-02253 (Beilstein Handbook Reference)
  • AI3-61350
  • Benzylcarbamide
  • Benzylurea
  • BRN 2208083
  • EC 208-689-1
  • EINECS 208-689-1
  • N-Benzylurea
  • N-Phenyl-N'-methylurea
  • NSC 109103
  • Phenylmethylurea
  • UNII-0K14I09J76

Systematic Names

  • Benzylurea
  • Urea, (phenylmethyl)- (9CI)
  • Urea, benzyl-

Registry Numbers

CAS Registry Number

  • 538-32-9

FDA UNII

  • 0K14I09J76

System Generated Number

  • 0000538329

Structure Descriptors

InChI

1S/C8H10N2O/c9-8(11)10-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11)

InChIKey

RJNJWHFSKNJCTB-UHFFFAOYSA-N

Smiles

c1(CNC(N)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 570mg/kg (570mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Journal of Medicinal Chemistry. Vol. 11, Pg. 814, 1968.
mouse LDLo intraperitoneal 450mg/kg (450mg/kg) BEHAVIORAL: GENERAL ANESTHETIC

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Journal of Pharmacology and Experimental Therapeutics. Vol. 54, Pg. 188, 1935.
rat LD50 oral 2700mg/kg (2700mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 44(3), Pg. 68, 1979.
rat LD50 oral 4410mg/kg (4410mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 44(3), Pg. 68, 1979.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 148 deg C   EXP
log P (octanol-water) 0.73 (none)   EXP
Water Solubility 1.70E+04 mg/L 45 EXP
Vapor Pressure 3.44E-04 mm Hg 25 EST
Henry's Law Constant 6.47E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.07E-11 cm3/molecule-sec 25 EST

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