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Substance Name: 1-Bromopropane
RN: 106-94-5
UNII: Y9746DNE68
InChIKey: CYNYIHKIEHGYOZ-UHFFFAOYSA-N

Note

  • Used as a solvent.

Molecular Formula

  • C3-H7-Br

Molecular Weight

  • 122.9923
 

Classification Codes

Classification Code

  • Reproductive Effect

Superlist Classification Codes

  • Reasonably Anticipated to be a Human Carcinogen.
  • TWA 10 ppm
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Names and Synonyms

Name of Substance

  • 1-Bromopropane
  • Propyl bromide

Synonyms

  • 1-BP
  • 1-Bromopropane
  • AI3-18129
  • CCRIS 30
  • EC 203-445-0
  • EINECS 203-445-0
  • HSDB 1068
  • n-Propyl bromide
  • nPB
  • Propane, 1-bromo-
  • Propyl bromide
  • UNII-Y9746DNE68

Systematic Names

  • 1-Bromopropane
  • Propane, 1-bromo-

Superlist Names

  • 1-Bromopropane
  • n-Propyl bromide
  • Propane, 1-bromo-

Registry Numbers

CAS Registry Number

  • 106-94-5

FDA UNII

  • Y9746DNE68

System Generated Number

  • 0000106945

Structure Descriptors

InChI

1S/C3H7Br/c1-2-3-4/h2-3H2,1H3

InChIKey

CYNYIHKIEHGYOZ-UHFFFAOYSA-N

Smiles

C(CBr)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2530mg/kg (2530mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 102, 1982.
rat LC50 inhalation 253gm/m3/30M (253000mg/m3)   Fiziologicheski Aktivnye Veshchestva. Physiologically Active Substances. Vol. 7, Pg. 35, 1975.
rat LD50 intraperitoneal 2950mg/kg (2950mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 102, 1982.
rat LDLo oral 4gm/kg (4000mg/kg)   Mutation Research. Vol. 101, Pg. 321, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.10E+02 deg C   EXP
Boiling Point 71.1 deg C   EXP
log P (octanol-water) 2.1 (none)   EXP
Water Solubility 2450 mg/L 20 EXP
Vapor Pressure 111 mm Hg 20 EXP
Henry's Law Constant 7.32E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.18E-12 cm3/molecule-sec 25 EXP

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