ChemSpider 2D Image | (3S)-3-[Bis(3,5-diisopropylphenyl)phosphoryl]-3-phenyl-1-propanol | C33H45O2P

(3S)-3-[Bis(3,5-diisopropylphenyl)phosphoryl]-3-phenyl-1-propanol

  • Molecular FormulaC33H45O2P
  • Average mass504.683 Da
  • Monoisotopic mass504.315704 Da
  • ChemSpider ID26994762

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-[Bis(3,5-diisopropylphenyl)phosphoryl]-3-phenyl-1-propanol [German] [ACD/IUPAC Name]
(3S)-3-[Bis(3,5-diisopropylphenyl)phosphoryl]-3-phenyl-1-propanol [ACD/IUPAC Name]
(3S)-3-[Bis(3,5-diisopropylphényl)phosphoryl]-3-phényl-1-propanol [French] [ACD/IUPAC Name]
Benzenepropanol, γ-[bis[3,5-bis(1-methylethyl)phenyl]phosphinyl]-, (γS)- [ACD/Index Name]
(S)-3-(bis(3,5-diisopropylphenyl)phosphoryl)-3-phenylpropan -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: 597.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.6±3.0 kJ/mol
Flash Point: 315.0±30.1 °C
Index of Refraction: 1.558
Molar Refractivity: 153.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.43
ACD/LogD (pH 5.5): 7.94
ACD/BCF (pH 5.5): 634571.00
ACD/KOC (pH 5.5): 495434.06
ACD/LogD (pH 7.4): 7.94
ACD/BCF (pH 7.4): 634571.00
ACD/KOC (pH 7.4): 495434.06
Polar Surface Area: 47 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 43.2±5.0 dyne/cm
Molar Volume: 477.1±5.0 cm3

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