ChemSpider 2D Image | (2S)-1,2-Dihydroxy-3-oxopropyl dihydrogen phosphate | C3H7O7P

(2S)-1,2-Dihydroxy-3-oxopropyl dihydrogen phosphate

  • Molecular FormulaC3H7O7P
  • Average mass186.057 Da
  • Monoisotopic mass185.992935 Da
  • ChemSpider ID61325254

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-1,2-Dihydroxy-3-oxopropyl dihydrogen phosphate [ACD/IUPAC Name]
(2S)-1,2-Dihydroxy-3-oxopropyldihydrogenphosphat [German] [ACD/IUPAC Name]
Dihydrogénophosphate de (2S)-1,2-dihydroxy-3-oxopropyle [French] [ACD/IUPAC Name]
Propanal, 2,3-dihydroxy-3-(phosphonooxy)-, (2S)- [ACD/Index Name]
1933792-54-1 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 485.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.5±6.0 kJ/mol
Flash Point: 247.4±31.5 °C
Index of Refraction: 1.550
Molar Refractivity: 30.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.75
ACD/LogD (pH 5.5): -6.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 134 Å2
Polarizability: 12.2±0.5 10-24cm3
Surface Tension: 111.1±3.0 dyne/cm
Molar Volume: 96.7±3.0 cm3

Click to predict properties on the Chemicalize site


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