ChemSpider 2D Image | (1S)-1-(1H-Benzimidazol-2-yl)ethyl (3,4-dichlorophenyl)carbamate | C16H13Cl2N3O2

(1S)-1-(1H-Benzimidazol-2-yl)ethyl (3,4-dichlorophenyl)carbamate

  • Molecular FormulaC16H13Cl2N3O2
  • Average mass350.199 Da
  • Monoisotopic mass349.038483 Da
  • ChemSpider ID25057786
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(1S)-1-(1H-Benzimidazol-2-yl)ethyl (3,4-dichlorophenyl)carbamate [ACD/IUPAC Name]
(1S)-1-(1H-Benzimidazol-2-yl)ethyl-(3,4-dichlorphenyl)carbamat [German] [ACD/IUPAC Name]
(3,4-Dichlorophényl)carbamate de (1S)-1-(1H-benzimidazol-2-yl)éthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-(3,4-dichlorophenyl)-, (1S)-1-(1H-benzimidazol-2-yl)ethyl ester [ACD/Index Name]
AGX

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 508.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.6±30.1 °C
Index of Refraction: 1.702
Molar Refractivity: 91.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 1900.07
ACD/KOC (pH 5.5): 7254.00
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2374.77
ACD/KOC (pH 7.4): 9066.30
Polar Surface Area: 67 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 236.4±3.0 cm3

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