ChemSpider 2D Image | (3S)-3-(Diphenylphosphoryl)-4-methyl-1-pentanol | C18H23O2P

(3S)-3-(Diphenylphosphoryl)-4-methyl-1-pentanol

  • Molecular FormulaC18H23O2P
  • Average mass302.348 Da
  • Monoisotopic mass302.143555 Da
  • ChemSpider ID26994777

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(Diphenylphosphoryl)-4-methyl-1-pentanol [German] [ACD/IUPAC Name]
(3S)-3-(Diphenylphosphoryl)-4-methyl-1-pentanol [ACD/IUPAC Name]
(3S)-3-(Diphénylphosphoryl)-4-méthyl-1-pentanol [French] [ACD/IUPAC Name]
1-Pentanol, 3-(diphenylphosphinyl)-4-methyl-, (3S)- [ACD/Index Name]
(S)-3-(diphenylphosphoryl)-4-methylpentan-1-ol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 427.7±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 212.5±24.0 °C
Index of Refraction: 1.554
Molar Refractivity: 87.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 126.40
ACD/KOC (pH 5.5): 1111.84
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 126.40
ACD/KOC (pH 7.4): 1111.84
Polar Surface Area: 47 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 43.8±5.0 dyne/cm
Molar Volume: 273.0±5.0 cm3

Click to predict properties on the Chemicalize site


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