ChemSpider 2D Image | 4-Amino-2-(2,3,4-trinitrophenyl)butanoic acid | C10H10N4O8

4-Amino-2-(2,3,4-trinitrophenyl)butanoic acid

  • Molecular FormulaC10H10N4O8
  • Average mass314.208 Da
  • Monoisotopic mass314.049866 Da
  • ChemSpider ID67158958

More details:

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

4-Amino-2-(2,3,4-trinitrophenyl)butanoic acid [ACD/IUPAC Name]
4-Amino-2-(2,3,4-trinitrophenyl)butansäure [German] [ACD/IUPAC Name]
Acide 4-amino-2-(2,3,4-trinitrophényl)butanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-(2-aminoethyl)-2,3,4-trinitro- [ACD/Index Name]
trinitrophenyl-g-aminobutyric acid

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

Density: 1.7±0.1 g/cm3
Boiling Point: 600.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 317.1±31.5 °C
Index of Refraction: 1.657
Molar Refractivity: 69.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.45
ACD/LogD (pH 5.5): -1.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 201 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 86.8±3.0 dyne/cm
Molar Volume: 189.8±3.0 cm3

Click to predict properties on the Chemicalize site


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