ChemSpider 2D Image | 1-[(4-Chloro-2-methoxy-5-methylphenyl)amino]-1-oxo-2-propanyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate | C16H18ClN3O5

1-[(4-Chloro-2-methoxy-5-methylphenyl)amino]-1-oxo-2-propanyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate

  • Molecular FormulaC16H18ClN3O5
  • Average mass367.784 Da
  • Monoisotopic mass367.093506 Da
  • ChemSpider ID21956175

More details:

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

1-[(4-Chlor-2-methoxy-5-methylphenyl)amino]-1-oxo-2-propanyl-5-amino-3-methyl-1,2-oxazol-4-carboxylat [German] [ACD/IUPAC Name]
1-[(4-Chloro-2-methoxy-5-methylphenyl)amino]-1-oxo-2-propanyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate [ACD/IUPAC Name]
4-Isoxazolecarboxylic acid, 5-amino-3-methyl-, 2-[(4-chloro-2-methoxy-5-methylphenyl)amino]-1-methyl-2-oxoethyl ester [ACD/Index Name]
5-Amino-3-méthyl-1,2-oxazole-4-carboxylate de 1-[(4-chloro-2-méthoxy-5-méthylphényl)amino]-1-oxo-2-propanyle [French] [ACD/IUPAC 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: 575.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 302.1±30.1 °C
Index of Refraction: 1.604
Molar Refractivity: 92.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 165.31
ACD/KOC (pH 5.5): 1347.27
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 165.29
ACD/KOC (pH 7.4): 1347.14
Polar Surface Area: 117 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 268.5±3.0 cm3

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