ChemSpider 2D Image | (1R,2R)-1,2-Dichloropropyl (2S)-2,3-dichloropropyl 3,3-dichloropropyl (R)-phosphate | C9H15Cl6O4P

(1R,2R)-1,2-Dichloropropyl (2S)-2,3-dichloropropyl 3,3-dichloropropyl (R)-phosphate

  • Molecular FormulaC9H15Cl6O4P
  • Average mass430.905 Da
  • Monoisotopic mass427.883911 Da
  • ChemSpider ID78430692

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,2R)-1,2-Dichloropropyl (2S)-2,3-dichloropropyl 3,3-dichloropropyl (R)-phosphate [ACD/IUPAC Name]
(1R,2R)-1,2-Dichlorpropyl-(2S)-2,3-dichlorpropyl-3,3-dichlorpropyl(R)-phosphat [German] [ACD/IUPAC Name]
(R)-Phosphate de (1R,2R)-1,2-dichloropropyle et de (2S)-2,3-dichloropropyle et de 3,3-dichloropropyle [French] [ACD/IUPAC Name]
Phosphoric acid, (1R,2R)-1,2-dichloropropyl (2S)-2,3-dichloropropyl 3,3-dichloropropyl ester, (R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 458.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 378.6±36.4 °C
Index of Refraction: 1.496
Molar Refractivity: 84.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 273.35
ACD/KOC (pH 5.5): 1931.14
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 273.35
ACD/KOC (pH 7.4): 1931.14
Polar Surface Area: 55 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 290.1±3.0 cm3

Click to predict properties on the Chemicalize site


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