ChemSpider 2D Image | Ethyl 5-benzyl-2-[(3,4-dichlorobenzoyl)amino]-3-thiophenecarboxylate | C21H17Cl2NO3S

Ethyl 5-benzyl-2-[(3,4-dichlorobenzoyl)amino]-3-thiophenecarboxylate

  • Molecular FormulaC21H17Cl2NO3S
  • Average mass434.336 Da
  • Monoisotopic mass433.030609 Da
  • ChemSpider ID22750156

More details:

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

3-Thiophenecarboxylic acid, 2-[(3,4-dichlorobenzoyl)amino]-5-(phenylmethyl)-, ethyl ester [ACD/Index Name]
5-Benzyl-2-[(3,4-dichlorobenzoyl)amino]-3-thiophènecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-benzyl-2-[(3,4-dichlorobenzoyl)amino]-3-thiophenecarboxylate [ACD/IUPAC Name]
Ethyl-5-benzyl-2-[(3,4-dichlorbenzoyl)amino]-3-thiophencarboxylat [German] [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: 523.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.1±30.1 °C
Index of Refraction: 1.648
Molar Refractivity: 114.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.97
ACD/LogD (pH 5.5): 6.54
ACD/BCF (pH 5.5): 55162.80
ACD/KOC (pH 5.5): 86228.69
ACD/LogD (pH 7.4): 6.54
ACD/BCF (pH 7.4): 55158.50
ACD/KOC (pH 7.4): 86221.97
Polar Surface Area: 84 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 315.5±3.0 cm3

Click to predict properties on the Chemicalize site


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