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Substance Name: 3-Hexanone, 2,5-dimethyl- (8CI)(9CI)
RN: 1888-57-9
InChIKey: TUIWMHDSXJWXOH-UHFFFAOYSA-N

Molecular Formula

  • C8-H16-O

Molecular Weight

  • 128.213
 
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Names and Synonyms

Synonyms

  • 2,5-Dimethyl-3-hexanone
  • Isobutyl isopropyl ketone
  • NSC 940

Systematic Name

  • 3-Hexanone, 2,5-dimethyl- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 1888-57-9

System Generated Number

  • 0001888579

Structure Descriptors

InChI

1S/C8H16O/c1-6(2)5-8(9)7(3)4/h6-7H,5H2,1-4H3

InChIKey

TUIWMHDSXJWXOH-UHFFFAOYSA-N

Smiles

C(CC(C)C)(C(C)C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 147.5 deg C   EXP
log P (octanol-water) 2.070 (none)   EST
Atmospheric OH Rate Constant 1.13E-11 cm3/molecule-sec 25 EST

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