ChemSpider 2D Image | N,alpha-Difluoro-N-(phosphonomethyl)-L-phenylalanine | C10H12F2NO5P

N,α-Difluoro-N-(phosphonomethyl)-L-phenylalanine

  • Molecular FormulaC10H12F2NO5P
  • Average mass295.177 Da
  • Monoisotopic mass295.042114 Da
  • ChemSpider ID67492637

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Phenylalanine, N,α-difluoro-N-(phosphonomethyl)- [ACD/Index Name]
N,α-Difluor-N-(phosphonomethyl)-L-phenylalanin [German] [ACD/IUPAC Name]
N,α-Difluoro-N-(phosphonomethyl)-L-phenylalanine [ACD/IUPAC Name]
N,α-Difluoro-N-(phosphonométhyl)-L-phénylalanine [French] [ACD/IUPAC Name]
difluoro-phosphonomethyl phenylalanine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 522.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 269.5±32.9 °C
Index of Refraction: 1.561
Molar Refractivity: 60.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -4.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 187.2±3.0 cm3

Click to predict properties on the Chemicalize site


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