ChemSpider 2D Image | N-[(1R)-1-Phosphonoethyl]-D-alaninamide | C5H13N2O4P

N-[(1R)-1-Phosphonoethyl]-D-alaninamide

  • Molecular FormulaC5H13N2O4P
  • Average mass196.141 Da
  • Monoisotopic mass196.061295 Da
  • ChemSpider ID62639333

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-Propanaminium, 1-oxo-1-[[(1R)-1-phosphonoethyl]amino]-, inner salt, (2R)- [ACD/Index Name]
Hydrogen [(1R)-1-{[(2R)-2-ammoniopropanoyl]amino}ethyl]phosphonate [ACD/IUPAC Name]
Hydrogen[(1R)-1-{[(2R)-2-ammoniopropanoyl]amino}ethyl]phosphonat [German] [ACD/IUPAC Name]
Hydrogéno[(1R)-1-{[(2R)-2-ammoniopropanoyl]amino}éthyl]phosphonate [French] [ACD/IUPAC Name]
N-[(1R)-1-Phosphonoethyl]-D-alaninamid [German] [ACD/IUPAC Name]
N-[(1R)-1-Phosphonoethyl]-D-alaninamide [ACD/IUPAC Name]
N-[(1R)-1-Phosphonoéthyl]-D-alaninamide [French] [ACD/IUPAC Name]
Phosphonic acid, [(1R)-1-[[(2R)-2-amino-1-oxopropyl]amino]ethyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.513
Molar Refractivity: 42.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -2.89
ACD/LogD (pH 5.5): -5.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 61.3±3.0 dyne/cm
Molar Volume: 140.6±3.0 cm3

Click to predict properties on the Chemicalize site


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