ChemSpider 2D Image | [(1R,2S)-2-Amino-1-hydroxybutyl]phosphonic acid | C4H12NO4P

[(1R,2S)-2-Amino-1-hydroxybutyl]phosphonic acid

  • Molecular FormulaC4H12NO4P
  • Average mass169.116 Da
  • Monoisotopic mass169.050400 Da
  • ChemSpider ID59702399

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(1R,2S)-2-Amino-1-hydroxybutyl]phosphonic acid [ACD/IUPAC Name]
[(1R,2S)-2-Amino-1-hydroxybutyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(1R,2S)-2-amino-1-hydroxybutyl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [(1R,2S)-2-amino-1-hydroxybutyl]- [ACD/Index Name]
E'2-amino-1-hydroxybutylphosphonic acid'

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

Density: 1.5±0.1 g/cm3
Boiling Point: 426.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±6.0 kJ/mol
Flash Point: 211.7±31.5 °C
Index of Refraction: 1.526
Molar Refractivity: 35.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.86
ACD/LogD (pH 5.5): -4.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 72.4±3.0 dyne/cm
Molar Volume: 115.7±3.0 cm3

Click to predict properties on the Chemicalize site


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