ChemSpider 2D Image | N-(3-Cyano-2-thienyl)-2-iodo-3-methylbenzamide | C13H9IN2OS

N-(3-Cyano-2-thienyl)-2-iodo-3-methylbenzamide

  • Molecular FormulaC13H9IN2OS
  • Average mass368.193 Da
  • Monoisotopic mass367.948029 Da
  • ChemSpider ID49670116

More details:

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

Benzamide, N-(3-cyano-2-thienyl)-2-iodo-3-methyl- [ACD/Index Name]
N-(3-Cyan-2-thienyl)-2-iod-3-methylbenzamid [German] [ACD/IUPAC Name]
N-(3-Cyano-2-thienyl)-2-iodo-3-methylbenzamide [ACD/IUPAC Name]
N-(3-Cyano-2-thiényl)-2-iodo-3-méthylbenzamide [French] [ACD/IUPAC Name]
N-(3-cyanothiophen-2-yl)-2-iodo-3-methylbenzamide

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

Density: 1.8±0.1 g/cm3
Boiling Point: 418.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 207.0±28.7 °C
Index of Refraction: 1.702
Molar Refractivity: 80.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 247.20
ACD/KOC (pH 5.5): 1796.99
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 247.19
ACD/KOC (pH 7.4): 1796.95
Polar Surface Area: 81 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 68.8±5.0 dyne/cm
Molar Volume: 206.9±5.0 cm3

Click to predict properties on the Chemicalize site


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