Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3-Methylpentane
RN: 96-14-0
UNII: XD8O3ML76T
InChIKey: PFEOZHBOMNWTJB-UHFFFAOYSA-N

Molecular Formula

  • C6-H14

Molecular Weight

  • 86.1766
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 3-Methylpentane

Synonyms

  • 3-Methylpentane
  • AI3-28852
  • Diethylmethylmethane
  • EINECS 202-481-4
  • HSDB 5300
  • NSC 66497
  • Pentane, 3-methyl-
  • UNII-XD8O3ML76T

Systematic Names

  • 3-Methylpentane
  • Pentane, 3-methyl-

Superlist Names

  • 3-Methylpentane
  • Pentane, 3-methyl-

Registry Numbers

CAS Registry Number

  • 96-14-0

FDA UNII

  • XD8O3ML76T

System Generated Number

  • 0000096140

Structure Descriptors

InChI

1S/C6H14/c1-4-6(3)5-2/h6H,4-5H2,1-3H3

InChIKey

PFEOZHBOMNWTJB-UHFFFAOYSA-N

Smiles

C(CC)(CC)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.63E+02 deg C   EXP
Boiling Point 63.2 deg C   EXP
log P (octanol-water) 3.6 (none)   EXP
Water Solubility 17.9 mg/L 25 EXP
Vapor Pressure 190 mm Hg 25 EXP
Henry's Law Constant 1.680 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.70E-12 cm3/molecule-sec 25 EXP

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