ChemSpider 2D Image | [(1R,2R)-1,2,3-Trihydroxypropyl]phosphonic acid | C3H9O6P

[(1R,2R)-1,2,3-Trihydroxypropyl]phosphonic acid

  • Molecular FormulaC3H9O6P
  • Average mass172.074 Da
  • Monoisotopic mass172.013672 Da
  • ChemSpider ID61395919

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(1R,2R)-1,2,3-Trihydroxypropyl]phosphonic acid [ACD/IUPAC Name]
[(1R,2R)-1,2,3-Trihydroxypropyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(1R,2R)-1,2,3-trihydroxypropyl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [(1R,2R)-1,2,3-trihydroxypropyl]- [ACD/Index Name]
864166-21-2 [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: 610.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 104.0±6.0 kJ/mol
Flash Point: 323.0±34.3 °C
Index of Refraction: 1.587
Molar Refractivity: 30.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -3.22
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): -7.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 124.1±3.0 dyne/cm
Molar Volume: 90.5±3.0 cm3

Click to predict properties on the Chemicalize site


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