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Substance Name: 2,3,4-Trimethylhexane
RN: 921-47-1
InChIKey: RUTNOQHQISEBGT-UHFFFAOYSA-N

Molecular Formula

  • C9-H20

Molecular Weight

  • 128.257
 
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Names and Synonyms

Synonyms

  • 2,3,4-Trimethylhexane
  • EINECS 213-066-2

Systematic Names

  • 2,3,4-Trimethylhexane
  • Hexane, 2,3,4-trimethyl-

Registry Numbers

CAS Registry Number

  • 921-47-1

System Generated Number

  • 0000921471

Structure Descriptors

InChI

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

InChIKey

RUTNOQHQISEBGT-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 139.1 deg C   EXP
log P (octanol-water) 4.540 (none)   EST
Water Solubility 3.590 mg/L 25 EST
Henry's Law Constant 4.000 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.02E-11 cm3/molecule-sec 25 EST

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