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Substance Name: 2-Bromopropionic acid
RN: 598-72-1
UNII: UE0XVY2DT6
InChIKey: MONMFXREYOKQTI-UHFFFAOYSA-N

Molecular Formula

  • C3-H5-Br-O2

Molecular Weight

  • 152.975
 
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Names and Synonyms

Name of Substance

  • 2-Bromopropionic acid

Synonyms

  • 2-Bromopropanoic acid
  • 2-Bromopropionic acid
  • AI3-52314
  • alpha-Bromopropionic acid
  • CCRIS 8896
  • EC 209-947-6
  • EINECS 209-947-6
  • NSC 172
  • UNII-UE0XVY2DT6

Systematic Names

  • 2-Bromopropionic acid
  • Propanoic acid, 2-bromo-
  • Propionic acid, 2-bromo- (6CI,7CI,8CI)

Superlist Name

  • Propionic acid, 2-bromo-

Registry Numbers

CAS Registry Number

  • 598-72-1

FDA UNII

  • UE0XVY2DT6

Other Registry Number

  • 10327-08-9

System Generated Number

  • 0000598721

Structure Descriptors

InChI

1S/C3H5BrO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)

InChIKey

MONMFXREYOKQTI-UHFFFAOYSA-N

Smiles

C([C@@H](C)Br)(O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 203 deg C   EXP
pKa Dissociation Constant 2.97 (none) 18 EXP
log P (octanol-water) 0.92 (none)   EXP
Water Solubility 2.99E+04 mg/L 25 EST
Vapor Pressure 0.291 mm Hg 25 EST
Henry's Law Constant 8.38E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.90E-13 cm3/molecule-sec 25 EST

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