ChemSpider 2D Image | (2S)-3-Methoxy-2-(phosphonooxy)propanoic acid | C4H9O7P

(2S)-3-Methoxy-2-(phosphonooxy)propanoic acid

  • Molecular FormulaC4H9O7P
  • Average mass200.084 Da
  • Monoisotopic mass200.008591 Da
  • ChemSpider ID75139545

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-3-Methoxy-2-(phosphonooxy)propanoic acid [ACD/IUPAC Name]
(2S)-3-Methoxy-2-(phosphonooxy)propansäure [German] [ACD/IUPAC Name]
Acide (2S)-3-méthoxy-2-(phosphonooxy)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-methoxy-2-(phosphonooxy)-, (2S)- [ACD/Index 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: 435.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±6.0 kJ/mol
Flash Point: 217.4±31.5 °C
Index of Refraction: 1.497
Molar Refractivity: 35.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -6.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 73.3±3.0 dyne/cm
Molar Volume: 121.4±3.0 cm3

Click to predict properties on the Chemicalize site


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