ChemSpider 2D Image | N-[(4-Iodo-2-methoxyphenyl)carbamoyl]-N-methyl-beta-alanine | C12H15IN2O4

N-[(4-Iodo-2-methoxyphenyl)carbamoyl]-N-methyl-β-alanine

  • Molecular FormulaC12H15IN2O4
  • Average mass378.163 Da
  • Monoisotopic mass378.007629 Da
  • ChemSpider ID57991116

More details:

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

N-[(4-Iod-2-methoxyphenyl)carbamoyl]-N-methyl-β-alanin [German] [ACD/IUPAC Name]
N-[(4-Iodo-2-methoxyphenyl)carbamoyl]-N-methyl-β-alanine [ACD/IUPAC Name]
N-[(4-Iodo-2-méthoxyphényl)carbamoyl]-N-méthyl-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-[[(4-iodo-2-methoxyphenyl)amino]carbonyl]-N-methyl- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 561.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 293.6±30.1 °C
Index of Refraction: 1.640
Molar Refractivity: 79.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.06
ACD/LogD (pH 7.4): -1.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 79 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 220.0±3.0 cm3

Click to predict properties on the Chemicalize site


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