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Substance Name: 2,2-Dimethylhexane
RN: 590-73-8
InChIKey: FLTJDUOFAQWHDF-UHFFFAOYSA-N

Molecular Formula

  • C8-H18

Molecular Weight

  • 114.23
 
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Names and Synonyms

Synonyms

  • 2,2-Dimethylhexane
  • EINECS 209-689-4
  • NSC 174065

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 590-73-8

System Generated Number

  • 0000590738

Structure Descriptors

InChI

1S/C8H18/c1-5-6-7-8(2,3)4/h5-7H2,1-4H3

InChIKey

FLTJDUOFAQWHDF-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.21E+02 deg C   EXP
Boiling Point 106.8 deg C   EXP
log P (octanol-water) 4.160 (none)   EST
Water Solubility 0.2 mg/L 25 EXP
Vapor Pressure 34 mm Hg 25 EXP
Henry's Law Constant 36.8 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.83E-12 cm3/molecule-sec 25 EXP

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