ChemSpider 2D Image | Diethyl [(2R,3R)-3-methyl-1-(phenylcarbamoyl)-2-aziridinyl]phosphonate | C14H21N2O4P

Diethyl [(2R,3R)-3-methyl-1-(phenylcarbamoyl)-2-aziridinyl]phosphonate

  • Molecular FormulaC14H21N2O4P
  • Average mass312.301 Da
  • Monoisotopic mass312.123901 Da
  • ChemSpider ID62987885

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[(2R,3R)-3-Méthyl-1-(phénylcarbamoyl)-2-aziridinyl]phosphonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(2R,3R)-3-methyl-1-(phenylcarbamoyl)-2-aziridinyl]phosphonate [ACD/IUPAC Name]
Diethyl-[(2R,3R)-3-methyl-1-(phenylcarbamoyl)-2-aziridinyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(2R,3R)-3-methyl-1-[(phenylamino)carbonyl]-2-aziridinyl]-, diethyl ester [ACD/Index Name]
50524-29-3 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.541
Molar Refractivity: 79.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.35
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 55.70
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.93
ACD/KOC (pH 7.4): 55.70
Polar Surface Area: 77 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 46.8±5.0 dyne/cm
Molar Volume: 253.2±5.0 cm3

Click to predict properties on the Chemicalize site


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