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Substance Name: Propyl formate
RN: 110-74-7
UNII: WO1ARV6GTW
InChIKey: KFNNIILCVOLYIR-UHFFFAOYSA-N

Molecular Formula

  • C4-H8-O2

Molecular Weight

  • 88.1052
 
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Names and Synonyms

Name of Substance

  • Propyl formate

Synonyms

  • 4-02-00-00026 (Beilstein Handbook Reference)
  • AI3-24243
  • BRN 1739272
  • EINECS 203-798-0
  • FEMA No. 2943
  • Formiate de propyle
  • Formiate de propyle [French]
  • Formic acid, propyl ester
  • n-Propyl formate
  • Propyl formate
  • Propyl methanoate
  • Propylester kyseliny mravenci
  • Propylester kyseliny mravenci [Czech]
  • UNII-WO1ARV6GTW

Systematic Names

  • Formic acid, propyl ester
  • Propyl formate

Superlist Names

  • Formic acid, propyl ester
  • Propyl formate
  • Propyl formates
  • Propyl formates [UN1281] [Flammable liquid]
  • UN1281

Registry Numbers

CAS Registry Number

  • 110-74-7

FDA UNII

  • WO1ARV6GTW

System Generated Number

  • 0000110747

Structure Descriptors

InChI

1S/C4H8O2/c1-2-3-6-4-5/h4H,2-3H2,1H3

InChIKey

KFNNIILCVOLYIR-UHFFFAOYSA-N

Smiles

CCCOC=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3400mg/kg (3400mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.
rat LD50 oral 3980mg/kg (3980mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -9.29E+01 deg C   EXP
Boiling Point 80.9 deg C   EXP
log P (octanol-water) 0.83 (none)   EXP
Water Solubility 2.20E+04 mg/L 22 EXP
Vapor Pressure 82.6 mm Hg 25 EXP
Henry's Law Constant 4.35E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.38E-12 cm3/molecule-sec 25 EXP

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