ChemSpider 2D Image | Diethyl [(3S)-3-amino-4-hydroxybutyl]phosphonate | C8H20NO4P

Diethyl [(3S)-3-amino-4-hydroxybutyl]phosphonate

  • Molecular FormulaC8H20NO4P
  • Average mass225.223 Da
  • Monoisotopic mass225.112991 Da
  • ChemSpider ID75100459

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(3S)-3-Amino-4-hydroxybutyl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(3S)-3-amino-4-hydroxybutyl]phosphonate [ACD/IUPAC Name]
Diethyl-[(3S)-3-amino-4-hydroxybutyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(3S)-3-amino-4-hydroxybutyl]-, diethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 366.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.9±6.0 kJ/mol
Flash Point: 175.3±25.1 °C
Index of Refraction: 1.460
Molar Refractivity: 54.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.60
ACD/LogD (pH 5.5): -3.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 199.0±3.0 cm3

Click to predict properties on the Chemicalize site


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