ChemSpider 2D Image | 2,3,3-Trihydroxy-2-propen-1-yl dihydrogen phosphate | C3H7O7P

2,3,3-Trihydroxy-2-propen-1-yl dihydrogen phosphate

  • Molecular FormulaC3H7O7P
  • Average mass186.057 Da
  • Monoisotopic mass185.992935 Da
  • ChemSpider ID95682289

More details:

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

1-Propene-1,1,2,3-tetrol, 3-(dihydrogen phosphate) [ACD/Index Name]
2,3,3-Trihydroxy-2-propen-1-yl dihydrogen phosphate [ACD/IUPAC Name]
2,3,3-Trihydroxy-2-propen-1-yldihydrogenphosphat [German] [ACD/IUPAC Name]
Dihydrogénophosphate de 2,3,3-trihydroxy-2-propén-1-yle [French] [ACD/IUPAC Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 564.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 92.7±6.0 kJ/mol
Flash Point: 295.4±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 32.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.45
ACD/LogD (pH 5.5): -4.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 12.7±0.5 10-24cm3
Surface Tension: 138.7±3.0 dyne/cm
Molar Volume: 89.3±3.0 cm3

Click to predict properties on the Chemicalize site


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