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Substance Name: Hexane, 3-ethyl-2-methyl-
RN: 16789-46-1
InChIKey: MVLOWDRGPHBNNF-UHFFFAOYSA-N

Molecular Formula

  • C9-H20

Molecular Weight

  • 128.257
 
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Names and Synonyms

Synonym

  • 2-Ethyl-3-methylhexane

Systematic Name

  • Hexane, 3-ethyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 16789-46-1

System Generated Number

  • 0016789461

Structure Descriptors

InChI

1S/C9H20/c1-5-7-9(6-2)8(3)4/h8-9H,5-7H2,1-4H3

InChIKey

MVLOWDRGPHBNNF-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 138 deg C   EXP
log P (octanol-water) 4.610 (none)   EST
Atmospheric OH Rate Constant 1.04E-11 cm3/molecule-sec 25 EST

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