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Substance Name: 1-Chloropropane
RN: 540-54-5
UNII: TUV7462NWK
InChIKey: SNMVRZFUUCLYTO-UHFFFAOYSA-N

Molecular Formula

  • C3-H7-Cl

Molecular Weight

  • 78.5413
 
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Names and Synonyms

Name of Substance

  • 1-Chloropropane

Synonyms

  • 1-Chloropropane
  • 4-01-00-00189 (Beilstein Handbook Reference)
  • AI3-28788
  • BRN 1730771
  • CCRIS 9257
  • EINECS 208-749-7
  • HSDB 5681
  • n-Propyl chloride
  • Propane, 1-chloro-
  • Propyl chloride
  • UNII-TUV7462NWK

Systematic Names

  • 1-Chloropropane
  • Propane, 1-chloro-

Superlist Names

  • n-Propyl chloride
  • Propane, 1-chloro-
  • Propyl chloride
  • Propyl chloride [UN1278] [Flammable liquid]
  • UN1278

Registry Numbers

CAS Registry Number

  • 540-54-5

FDA UNII

  • TUV7462NWK

System Generated Number

  • 0000540545

Structure Descriptors

InChI

1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3

InChIKey

SNMVRZFUUCLYTO-UHFFFAOYSA-N

Smiles

CCCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 2gm/kg (2000mg/kg)   Mutation Research. Vol. 101, Pg. 321, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.23E+02 deg C   EXP
Boiling Point 46.5 deg C   EXP
log P (octanol-water) 2.04 (none)   EXP
Water Solubility 2720 mg/L 25 EXP
Vapor Pressure 345 mm Hg 25 EXP
Henry's Law Constant 0.013 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.12E-12 cm3/molecule-sec 25 EXP

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