ChemSpider 2D Image | 2-Chloro-3-hydroxypropyl dihydrogen phosphate | C3H8ClO5P

2-Chloro-3-hydroxypropyl dihydrogen phosphate

  • Molecular FormulaC3H8ClO5P
  • Average mass190.519 Da
  • Monoisotopic mass189.979782 Da
  • ChemSpider ID60606033

More details:

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

1,3-Propanediol, 2-chloro-, mono(dihydrogen phosphate) [ACD/Index Name]
2-Chlor-3-hydroxypropyldihydrogenphosphat [German] [ACD/IUPAC Name]
2-Chloro-3-hydroxypropyl dihydrogen phosphate [ACD/IUPAC Name]
Dihydrogénophosphate de 2-chloro-3-hydroxypropyle [French] [ACD/IUPAC Name]
54857-44-2 [RN]
MFCD20631457

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 416.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.3±6.0 kJ/mol
Flash Point: 205.5±31.5 °C
Index of Refraction: 1.514
Molar Refractivity: 34.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.69
ACD/LogD (pH 5.5): -4.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 97 Å2
Polarizability: 13.5±0.5 10-24cm3
Surface Tension: 72.5±3.0 dyne/cm
Molar Volume: 112.8±3.0 cm3

Click to predict properties on the Chemicalize site


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