ChemSpider 2D Image | (2S)-6-Methyl-2-heptanol | C8H18O

(2S)-6-Methyl-2-heptanol

  • Molecular FormulaC8H18O
  • Average mass130.228 Da
  • Monoisotopic mass130.135757 Da
  • ChemSpider ID21428312

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-6-Methyl-2-heptanol [ACD/IUPAC Name]
(2S)-6-Methyl-2-heptanol [German] [ACD/IUPAC Name]
(2S)-6-Méthyl-2-heptanol [French] [ACD/IUPAC Name]
2-Heptanol, 6-methyl-, (2S)- [ACD/Index Name]
(2S)-6-METHYLHEPTAN-2-OL
(2S)-6-METHYLHEPTAN-2-OL|(2S)-6-METHYLHEPTAN-2-OL
(S)-6-methylheptan-2-ol
87247-19-6 [RN]
MFCD16661216 [MDL number]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.8±0.1 g/cm3
Boiling Point: 176.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.7 mmHg at 25°C
Enthalpy of Vaporization: 48.0±6.0 kJ/mol
Flash Point: 67.2±0.0 °C
Index of Refraction: 1.424
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.82
ACD/KOC (pH 5.5): 587.30
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.82
ACD/KOC (pH 7.4): 587.30
Polar Surface Area: 20 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 27.0±3.0 dyne/cm
Molar Volume: 158.8±3.0 cm3

Click to predict properties on the Chemicalize site


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