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Substance Name: 2-Methylpentan-3-one
RN: 565-69-5
UNII: 0R392X5X26
InChIKey: HYTRYEXINDDXJK-UHFFFAOYSA-N

Molecular Formula

  • C6-H12-O

Molecular Weight

  • 100.16
 
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Names and Synonyms

Name of Substance

  • 2-Methylpentan-3-one

Synonyms

  • 2-Methyl-3-pentanone
  • EINECS 209-288-4
  • UNII-0R392X5X26

Systematic Names

  • 2-Methylpentan-3-one
  • 3-Pentanone, 2-methyl-

Registry Numbers

CAS Registry Number

  • 565-69-5

FDA UNII

  • 0R392X5X26

System Generated Number

  • 0000565695

Structure Descriptors

InChI

InChI=1S/C6H12O/c1-4-6(7)5(2)3/h5H,4H2,1-3H3

InChIKey

HYTRYEXINDDXJK-UHFFFAOYSA-N

Smiles

CCC(=O)C(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 113.5 deg C   EXP
log P (octanol-water) 1.160 (none)   EST
Water Solubility 1.55E+04 mg/L 25 EXP
Vapor Pressure 18.1 mm Hg 25 EXP
Henry's Law Constant 1.54E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.75E-12 cm3/molecule-sec 25 EST

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