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Substance Name: 2,5-Dimethylhexane
RN: 592-13-2
InChIKey: UWNADWZGEHDQAB-UHFFFAOYSA-N

Molecular Formula

  • C8-H18

Molecular Weight

  • 114.23
 
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Names and Synonyms

Synonyms

  • 2,5-Dimethylhexane
  • Biisobutyl
  • EINECS 209-745-8
  • NSC 74172

Systematic Names

  • 2,5-Dimethylhexane
  • Hexane, 2,5-dimethyl-
  • Hexane, 2,5-dimethyl- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 592-13-2

System Generated Number

  • 0000592132

Structure Descriptors

InChI

1S/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H3

InChIKey

UWNADWZGEHDQAB-UHFFFAOYSA-N

Smiles

C(CCC(C)C)(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -9.10E+01 deg C   EXP
Boiling Point 109.1 deg C   EXP
log P (octanol-water) 4.120 (none)   EST
Water Solubility 9.200 mg/L 25 EST
Vapor Pressure 30.3 mm Hg 25 EXP
Henry's Law Constant 3.010 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.27E-12 cm3/molecule-sec 25 EST

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