ChemSpider 2D Image | (3R)-3-Hydroxy-4-oxobutyl dihydrogen phosphate | C4H9O6P

(3R)-3-Hydroxy-4-oxobutyl dihydrogen phosphate

  • Molecular FormulaC4H9O6P
  • Average mass184.084 Da
  • Monoisotopic mass184.013672 Da
  • ChemSpider ID28480619

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Hydroxy-4-oxobutyl dihydrogen phosphate [ACD/IUPAC Name]
(3R)-3-Hydroxy-4-oxobutyldihydrogenphosphat [German] [ACD/IUPAC Name]
Butanal, 2-hydroxy-4-(phosphonooxy)-, (2R)- [ACD/Index Name]
Dihydrogénophosphate de (3R)-3-hydroxy-4-oxobutyle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 441.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±6.0 kJ/mol
Flash Point: 221.0±31.5 °C
Index of Refraction: 1.501
Molar Refractivity: 34.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.89
ACD/LogD (pH 5.5): -5.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 13.5±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 115.3±3.0 cm3

Click to predict properties on the Chemicalize site


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