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Substance Name: Hexane, 3-ethyl-
RN: 619-99-8
InChIKey: SFRKSDZMZHIISH-UHFFFAOYSA-N

Molecular Formula

  • C8-H18

Molecular Weight

  • 114.23
 
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Names and Synonyms

Synonyms

  • 3-Ethylhexane
  • EINECS 210-621-0
  • NSC 74175

Systematic Names

  • 3-Ethylhexane
  • Hexane, 3-ethyl-

Registry Numbers

CAS Registry Number

  • 619-99-8

System Generated Number

  • 0000619998

Structure Descriptors

InChI

1S/C8H18/c1-4-7-8(5-2)6-3/h8H,4-7H2,1-3H3

InChIKey

SFRKSDZMZHIISH-UHFFFAOYSA-N

Smiles

C(CCC)(CC)CC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 118.6 deg C   EXP
log P (octanol-water) 4.200 (none)   EST
Water Solubility 7.970 mg/L 25 EST
Vapor Pressure 20 mm Hg 25 EXP
Henry's Law Constant 3.010 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.97E-12 cm3/molecule-sec 25 EST

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