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Substance Name: 5,5-Dimethylhexane-2,4-dione
RN: 7307-04-2
InChIKey: LCLCVVVHIPPHCG-UHFFFAOYSA-N

Molecular Formula

  • C8-H14-O2

Molecular Weight

  • 142.197
 
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Names and Synonyms

Synonyms

  • AI3-19023
  • EINECS 230-760-0

Systematic Names

  • 2,4-Hexanedione, 5,5-dimethyl-
  • 5,5-Dimethylhexane-2,4-dione

Registry Numbers

CAS Registry Number

  • 7307-04-2

System Generated Number

  • 0007307042

Structure Descriptors

InChI

1S/C8H14O2/c1-6(9)5-7(10)8(2,3)4/h5H2,1-4H3

InChIKey

LCLCVVVHIPPHCG-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.67 (none)   EXP
Water Solubility 3070 mg/L 25 EST
Vapor Pressure 1.110 mm Hg 25 EST
Henry's Law Constant 7.80E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.22E-12 cm3/molecule-sec 25 EST

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