ChemSpider 2D Image | (2S,3E)-2-Amino-5-(diethoxyphosphoryl)-3-pentenoic acid | C9H18NO5P

(2S,3E)-2-Amino-5-(diethoxyphosphoryl)-3-pentenoic acid

  • Molecular FormulaC9H18NO5P
  • Average mass251.217 Da
  • Monoisotopic mass251.092255 Da
  • ChemSpider ID75254424

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S,3E)-2-Amino-5-(diethoxyphosphoryl)-3-pentenoic acid [ACD/IUPAC Name]
(2S,3E)-2-Amino-5-(diethoxyphosphoryl)-3-pentensäure [German] [ACD/IUPAC Name]
3-Pentenoic acid, 2-amino-5-(diethoxyphosphinyl)-, (2S,3E)- [ACD/Index Name]
Acide (2S,3E)-2-amino-5-(diéthoxyphosphoryl)-3-penténoïque [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 423.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 74.3±6.0 kJ/mol
Flash Point: 209.6±28.7 °C
Index of Refraction: 1.486
Molar Refractivity: 59.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): -2.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 206.3±3.0 cm3

Click to predict properties on the Chemicalize site


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