ChemSpider 2D Image | (S)-(2,4-Dichlorophenyl)(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)methanol | C12H15Cl2O4P

(S)-(2,4-Dichlorophenyl)(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)methanol

  • Molecular FormulaC12H15Cl2O4P
  • Average mass325.125 Da
  • Monoisotopic mass324.008514 Da
  • ChemSpider ID30656571

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-(2,4-Dichlorophenyl)(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)methanol [ACD/IUPAC Name]
(S)-(2,4-Dichlorophényl)(5,5-diméthyl-2-oxydo-1,3,2-dioxaphosphinan-2-yl)méthanol [French] [ACD/IUPAC Name]
(S)-(2,4-Dichlorphenyl)(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)methanol [German] [ACD/IUPAC Name]
1,3,2-Dioxaphosphorinane-2-methanol, α-(2,4-dichlorophenyl)-5,5-dimethyl-, 2-oxide, (αS)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 431.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 214.6±28.7 °C
Index of Refraction: 1.559
Molar Refractivity: 73.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 47.06
ACD/KOC (pH 5.5): 548.10
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 47.05
ACD/KOC (pH 7.4): 548.10
Polar Surface Area: 66 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 228.8±5.0 cm3

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