Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methyl pivalate
RN: 598-98-1
UNII: BFX9W386OX
InChIKey: CNMFHDIDIMZHKY-UHFFFAOYSA-N

Molecular Formula

  • C6-H12-O2

Molecular Weight

  • 116.159
 
* 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

  • Methyl pivalate

Synonyms

  • EINECS 209-959-1
  • Methyl pivalate
  • UNII-BFX9W386OX

Systematic Names

  • Methyl pivalate
  • Propanoic acid, 2,2-dimethyl-, methyl ester

Superlist Name

  • Pivalic acid, methyl ester

Registry Numbers

CAS Registry Number

  • 598-98-1

FDA UNII

  • BFX9W386OX

System Generated Number

  • 0000598981

Structure Descriptors

InChI

1S/C6H12O2/c1-6(2,3)5(7)8-4/h1-4H3

InChIKey

CNMFHDIDIMZHKY-UHFFFAOYSA-N

Smiles

O=C(C(C)(C)C)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 101.1 deg C   EXP
log P (octanol-water) 1.83 (none)   EXP
Water Solubility 2840 mg/L 25 EST
Vapor Pressure 33.9 mm Hg 25 EST
Henry's Law Constant 4.25E-04 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 7.19E-13 cm3/molecule-sec 25 EST

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