Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethyl valerate
RN: 539-82-2
UNII: 95R258T4P6
InChIKey: ICMAFTSLXCXHRK-UHFFFAOYSA-N

Molecular Formula

  • C7-H14-O2

Molecular Weight

  • 130.186
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Ethyl valerate

Synonyms

  • AI3-01270
  • EINECS 208-726-1
  • Ethyl n-valerate
  • Ethyl pentanoate
  • Ethyl valerate
  • Ethyl valerianate
  • FEMA No. 2462
  • NSC 8868
  • Pentanoic acid, ethyl ester
  • UNII-95R258T4P6
  • Valeric acid, ethyl ester

Systematic Names

  • Ethyl valerate
  • Pentanoic acid, ethyl ester
  • Valeric acid, ethyl ester (8CI)

Superlist Name

  • Ethyl valerate

Registry Numbers

CAS Registry Number

  • 539-82-2

FDA UNII

  • 95R258T4P6

System Generated Number

  • 0000539822

Structure Descriptors

InChI

1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3

InChIKey

ICMAFTSLXCXHRK-UHFFFAOYSA-N

Smiles

C(CCCC)(OCC)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -9.12E+01 deg C   EXP
Boiling Point 146.1 deg C   EXP
log P (octanol-water) 2.340 (none)   EST
Water Solubility 2210 mg/L 25 EXP
Vapor Pressure 4.8 mm Hg 25 EXP
Henry's Law Constant 3.72E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.75E-12 cm3/molecule-sec 25 EST

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