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Substance Name: 3-Methylpentan-2-one
RN: 565-61-7
InChIKey: UIHCLUNTQKBZGK-UHFFFAOYSA-N

Molecular Formula

  • C6-H12-O

Molecular Weight

  • 100.16
 
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Names and Synonyms

Synonyms

  • 3-Methyl-2-pentanone
  • EC 209-282-1
  • EINECS 209-282-1
  • Methyl 1-methylpropyl ketone
  • Methyl sec-butyl ketone
  • NSC 66492
  • sec-Butyl methyl ketone

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 565-61-7

System Generated Number

  • 0000565617

Structure Descriptors

InChI

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

InChIKey

UIHCLUNTQKBZGK-UHFFFAOYSA-N

Smiles

C([C@@H](CC)C)(C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 118 deg C   EXP
log P (octanol-water) 1.160 (none)   EST
Water Solubility 2.09E+04 mg/L 25 EXP
Vapor Pressure 11.6 mm Hg 25 EXP
Henry's Law Constant 7.32E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.23E-12 cm3/molecule-sec 25 EST

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