ChemSpider 2D Image | N-Carbamoyl-N-fluoro-beta-alanine | C4H7FN2O3

N-Carbamoyl-N-fluoro-β-alanine

  • Molecular FormulaC4H7FN2O3
  • Average mass150.108 Da
  • Monoisotopic mass150.044067 Da
  • ChemSpider ID67159094

More details:

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

N-Carbamoyl-N-fluoro-β-alanine [ACD/IUPAC Name]
N-Carbamoyl-N-fluoro-β-alanine [French] [ACD/IUPAC Name]
N-Carbamoyl-N-fluor-β-alanin [German] [ACD/IUPAC Name]
β-Alanine, N-(aminocarbonyl)-N-fluoro- [ACD/Index Name]
5-fluoro-??-ureidopropionic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 323.1±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 62.1±6.0 kJ/mol
Flash Point: 149.2±28.4 °C
Index of Refraction: 1.488
Molar Refractivity: 29.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.73
ACD/LogD (pH 5.5): -1.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 57.2±3.0 dyne/cm
Molar Volume: 102.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement