ChemSpider 2D Image | (3S)-3,7-Dimethyl-1-octen-2-ol | C10H20O

(3S)-3,7-Dimethyl-1-octen-2-ol

  • Molecular FormulaC10H20O
  • Average mass156.265 Da
  • Monoisotopic mass156.151413 Da
  • ChemSpider ID23010175
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3S)-3,7-Dimethyl-1-octen-2-ol [ACD/IUPAC Name]
(3S)-3,7-Dimethyl-1-octen-2-ol [German] [ACD/IUPAC Name]
(3S)-3,7-Diméthyl-1-octén-2-ol [French] [ACD/IUPAC Name]
1-Octen-2-ol, 3,7-dimethyl-, (3S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.8±0.1 g/cm3
Boiling Point: 213.0±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 52.3±6.0 kJ/mol
Flash Point: 85.2±12.8 °C
Index of Refraction: 1.442
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 212.65
ACD/KOC (pH 5.5): 1613.44
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 212.58
ACD/KOC (pH 7.4): 1612.92
Polar Surface Area: 20 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 27.2±3.0 dyne/cm
Molar Volume: 186.8±3.0 cm3

Click to predict properties on the Chemicalize site






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