ChemSpider 2D Image | Ethyl N-(3,4-dichlorobenzoyl)threoninate | C13H15Cl2NO4

Ethyl N-(3,4-dichlorobenzoyl)threoninate

  • Molecular FormulaC13H15Cl2NO4
  • Average mass320.168 Da
  • Monoisotopic mass319.037811 Da
  • ChemSpider ID34210911

More details:

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

1485735-70-3 [RN]
ethyl 2-[(3,4-dichlorophenyl)formamido]-3-hydroxybutanoate
Ethyl N-(3,4-dichlorobenzoyl)threoninate [ACD/IUPAC Name]
Ethyl-N-(3,4-dichlorbenzoyl)threoninat [German] [ACD/IUPAC Name]
N-(3,4-Dichlorobenzoyl)thréoninate d'éthyle [French] [ACD/IUPAC Name]
Threonine, N-(3,4-dichlorobenzoyl)-, ethyl ester [ACD/Index Name]
MFCD24842875

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

Density: 1.3±0.1 g/cm3
Boiling Point: 486.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 247.9±28.7 °C
Index of Refraction: 1.552
Molar Refractivity: 76.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.40
ACD/KOC (pH 5.5): 517.30
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.40
ACD/KOC (pH 7.4): 517.28
Polar Surface Area: 76 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 238.0±3.0 cm3

Click to predict properties on the Chemicalize site


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