ChemSpider 2D Image | 3-[(3,4-Dimethoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-methylpropanoic acid | C13H16N2O8

3-[(3,4-Dimethoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-methylpropanoic acid

  • Molecular FormulaC13H16N2O8
  • Average mass328.275 Da
  • Monoisotopic mass328.090668 Da
  • ChemSpider ID54480642

More details:

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

3-[(3,4-Dimethoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-methylpropanoic acid [ACD/IUPAC Name]
3-[(3,4-Dimethoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-methylpropansäure [German] [ACD/IUPAC Name]
Acide 3-[(3,4-diméthoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[(3,4-dimethoxy-5-nitrobenzoyl)amino]-2-hydroxy-2-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 551.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 287.3±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 76.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.85
ACD/LogD (pH 5.5): -1.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 231.3±3.0 cm3

Click to predict properties on the Chemicalize site


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