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Substance Name: 2,4-Dimethyl-3-pentanol
RN: 600-36-2
UNII: N54K81P01F
InChIKey: BAYAKMPRFGNNFW-UHFFFAOYSA-N

Molecular Formula

  • C7-H16-O

Molecular Weight

  • 116.202
 
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Names and Synonyms

Name of Substance

  • 2,4-Dimethyl-3-pentanol

Synonyms

  • 2,4-Dimethyl-3-hydroxypentane
  • 2,4-Dimethyl-3-pentanol
  • Diisopropylcarbinol
  • Diisopropylmethanol
  • EINECS 209-993-7
  • NSC 8696
  • UNII-N54K81P01F

Systematic Names

  • 2,4-Dimethylpentan-3-ol
  • 3-Pentanol, 2,4-dimethyl-

Registry Numbers

CAS Registry Number

  • 600-36-2

FDA UNII

  • N54K81P01F

System Generated Number

  • 0000600362

Structure Descriptors

InChI

1S/C7H16O/c1-5(2)7(8)6(3)4/h5-8H,1-4H3

InChIKey

BAYAKMPRFGNNFW-UHFFFAOYSA-N

Smiles

C(C(C)C)(C(C)C)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.00E+01 deg C   EXP
Boiling Point 138.7 deg C   EXP
log P (octanol-water) 2.090 (none)   EST
Water Solubility 7000 mg/L 25 EXP
Henry's Law Constant 2.34E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.59E-11 cm3/molecule-sec 25 EST

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