ChemSpider 2D Image | {2-Amino-3-[(~2~H_5_)phenylcarbonyl]phenyl}acetic acid | C15H8D5NO3

{2-Amino-3-[(2H5)phenylcarbonyl]phenyl}acetic acid

  • Molecular FormulaC15H8D5NO3
  • Average mass260.299 Da
  • Monoisotopic mass260.120941 Da
  • ChemSpider ID110404787

  • Non-standard isotope - Non-standard isotope

More details:

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

{2-Amino-3-[(2H5)phenylcarbonyl]phenyl}acetic acid [ACD/IUPAC Name]
{2-Amino-3-[(2H5)phenylcarbonyl]phenyl}essigsäure [German] [ACD/IUPAC Name]
Acide {2-amino-3-[(2H5)phénylcarbonyl]phényl}acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-amino-3-(phenyl-d5-carbonyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 520.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 268.3±28.7 °C
Index of Refraction: 1.644
Molar Refractivity: 71.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 1.55
ACD/KOC (pH 5.5): 20.89
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 28.3±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 197.3±3.0 cm3

Click to predict properties on the Chemicalize site


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