Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2,3,5-Trimethylhexane
RN: 1069-53-0
InChIKey: ODGLTLJZCVNPBU-UHFFFAOYSA-N

Molecular Formula

  • C9-H20

Molecular Weight

  • 128.257
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2,3,5-Trimethylhexane
  • EINECS 213-957-6

Systematic Names

  • 2,3,5-Trimethylhexane
  • Hexane, 2,3,5-trimethyl-

Registry Numbers

CAS Registry Number

  • 1069-53-0

System Generated Number

  • 0001069530

Structure Descriptors

InChI

1S/C9H20/c1-7(2)6-9(5)8(3)4/h7-9H,6H2,1-5H3

InChIKey

ODGLTLJZCVNPBU-UHFFFAOYSA-N

Smiles

C([C@@H](C(C)C)C)C(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.28E+02 deg C   EXP
Boiling Point 131.4 deg C   EXP
log P (octanol-water) 4.540 (none)   EST
Water Solubility 3.590 mg/L 25 EST
Vapor Pressure 11.7 mm Hg 25 EXP
Henry's Law Constant 4.000 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.88E-12 cm3/molecule-sec 25 EXP

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