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Substance Name: 1-Pentanol, 2,4-dimethyl- (8CI)(9CI)
RN: 6305-71-1
InChIKey: OVOVDHYEOQJKMD-UHFFFAOYSA-N

Molecular Formula

  • C7-H16-O

Molecular Weight

  • 116.202
 
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Names and Synonyms

Synonyms

  • AI3-38565
  • NSC 41179

Systematic Name

  • 1-Pentanol, 2,4-dimethyl- (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 6305-71-1

System Generated Number

  • 0006305711

Structure Descriptors

InChI

1S/C7H16O/c1-6(2)4-7(3)5-8/h6-8H,4-5H2,1-3H3

InChIKey

OVOVDHYEOQJKMD-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.170 (none)   EST
Water Solubility 2910 mg/L 25 EXP
Vapor Pressure 1.040 mm Hg 25 EST
Henry's Law Constant 2.34E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.14E-11 cm3/molecule-sec 25 EST

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