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Substance Name: Pentane, 2,2,3,4-tetramethyl-
RN: 1186-53-4
InChIKey: VZFMYOCAEQDWDY-UHFFFAOYSA-N

Molecular Formula

  • C9-H20

Molecular Weight

  • 128.257
 
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Names and Synonyms

Synonym

  • 2,2,3,4-Tetramethylpentane

Systematic Name

  • Pentane, 2,2,3,4-tetramethyl-

Superlist Names

  • 2,2,3,4-Tetramethylpentane
  • Pentane, 2,2,3,4-tetramethyl-

Registry Numbers

CAS Registry Number

  • 1186-53-4

System Generated Number

  • 0001186534

Structure Descriptors

InChI

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

InChIKey

VZFMYOCAEQDWDY-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 -1.21E+02 deg C   EXP
Boiling Point 133 deg C   EXP
log P (octanol-water) 4.500 (none)   EST
Water Solubility 3.870 mg/L 25 EST
Vapor Pressure 12.6 mm Hg 25 EXP
Henry's Law Constant 4.000 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.32E-12 cm3/molecule-sec 25 EST

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