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Substance Name: 3-Bromophenylurea
RN: 2989-98-2
UNII: 02R6NPO627
InChIKey: DHMRSMNEKFDABI-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-Br-N2-O

Molecular Weight

  • 215.049
 
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Names and Synonyms

Name of Substance

  • 3-Bromophenylurea

Synonyms

  • AI3-61351
  • UNII-02R6NPO627

Systematic Name

  • Urea, (3-bromophenyl)-

Registry Numbers

CAS Registry Number

  • 2989-98-2

FDA UNII

  • 02R6NPO627

System Generated Number

  • 0002989982

Structure Descriptors

InChI

1S/C7H7BrN2O/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11)

InChIKey

DHMRSMNEKFDABI-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)Br)NC(N)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.08 (none)   EXP
Water Solubility 612 mg/L 25 EST
Vapor Pressure 5.64E-05 mm Hg 25 EST
Henry's Law Constant 8.02E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.79E-11 cm3/molecule-sec 25 EST

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