ChemSpider 2D Image | (2S)-4-Phenyl-2-pentanol | C11H16O

(2S)-4-Phenyl-2-pentanol

  • Molecular FormulaC11H16O
  • Average mass164.244 Da
  • Monoisotopic mass164.120117 Da
  • ChemSpider ID65766948

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-4-Phenyl-2-pentanol [German] [ACD/IUPAC Name]
(2S)-4-Phenyl-2-pentanol [ACD/IUPAC Name]
(2S)-4-Phényl-2-pentanol [French] [ACD/IUPAC Name]
Benzenepropanol, α,γ-dimethyl-, (αS)- [ACD/Index Name]
(2S)-4-phenylpentan-2-ol
2227980-76-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 251.4±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 51.6±3.0 kJ/mol
Flash Point: 103.0±14.5 °C
Index of Refraction: 1.513
Molar Refractivity: 51.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.83
ACD/KOC (pH 5.5): 643.12
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 58.83
ACD/KOC (pH 7.4): 643.12
Polar Surface Area: 20 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 170.4±3.0 cm3

Click to predict properties on the Chemicalize site


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