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Substance Name: 1,2-Dibromopropane
RN: 78-75-1
UNII: FGB8O5N903
InChIKey: XFNJYAKDBJUJAJ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C3-H6-Br2

Molecular Weight

  • 201.888
 
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Names and Synonyms

Name of Substance

  • 1,2-Dibromopropane

Synonyms

  • 1,2-Dibromopropane
  • 2,3-Dibromopropane
  • 4-01-00-00215 (Beilstein Handbook Reference)
  • AI3-15405
  • BRN 1718884
  • CCRIS 6710
  • EINECS 201-139-1
  • HSDB 7379
  • Propylene dibromide
  • UNII-FGB8O5N903

Systematic Names

  • 1,2-Dibromopropane
  • Propane, 1,2-dibromo-

Superlist Name

  • 1,2-Dibromopropane

Registry Numbers

CAS Registry Number

  • 78-75-1

FDA UNII

  • FGB8O5N903

Other Registry Number

  • 120575-45-3

System Generated Number

  • 0000078751

Structure Descriptors

InChI

1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3

InChIKey

XFNJYAKDBJUJAJ-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   National Technical Information Service. Vol. AD691-490,
mouse LD50 oral 676mg/kg (676mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 41(3), Pg. 105, 1976.
rat LC50 inhalation 12gm/m3/4H (12000mg/m3)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 43, 1982.
rat LD50 oral 741mg/kg (741mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 41(3), Pg. 105, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.52E+01 deg C   EXP
Boiling Point 141.9 deg C   EXP
log P (octanol-water) 2.430 (none)   EST
Water Solubility 1430 mg/L 25 EXP
Vapor Pressure 7.84 mm Hg 25 EXP
Henry's Law Constant 1.46E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.33E-13 cm3/molecule-sec 25 EST

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