ChemSpider 2D Image | (2S)-Amino(4-phosphonophenyl)acetic acid | C8H10NO5P

(2S)-Amino(4-phosphonophenyl)acetic acid

  • Molecular FormulaC8H10NO5P
  • Average mass231.143 Da
  • Monoisotopic mass231.029663 Da
  • ChemSpider ID23193754

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-Amino(4-phosphonophenyl)acetic acid [ACD/IUPAC Name]
(2S)-Amino(4-phosphonophenyl)essigsäure [German] [ACD/IUPAC Name]
(2S)-amino(4-phosphonophenyl)ethanoic acid
Acide (2S)-amino(4-phosphonophényl)acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-amino-4-phosphono-, (αS)- [ACD/Index Name]
Amino-(4-phosphono-phenyl)-acetic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 515.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 265.6±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 51.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.74
ACD/LogD (pH 5.5): -4.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 131 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 88.1±5.0 dyne/cm
Molar Volume: 142.7±5.0 cm3

Click to predict properties on the Chemicalize site


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