ChemSpider 2D Image | 7-Chloro-1-(3-thienylmethyl)-1H-benzimidazole-2-thiol | C12H9ClN2S2

7-Chloro-1-(3-thienylmethyl)-1H-benzimidazole-2-thiol

  • Molecular FormulaC12H9ClN2S2
  • Average mass280.796 Da
  • Monoisotopic mass279.989563 Da
  • ChemSpider ID34123427

More details:

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

1H-Benzimidazole-2-thiol, 7-chloro-1-(3-thienylmethyl)- [ACD/Index Name]
7-Chlor-1-(3-thienylmethyl)-1H-benzimidazol-2-thiol [German] [ACD/IUPAC Name]
7-Chloro-1-(3-thienylmethyl)-1H-benzimidazole-2-thiol [ACD/IUPAC Name]
7-Chloro-1-(3-thiénylméthyl)-1H-benzimidazole-2-thiol [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 472.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 239.6±31.5 °C
Index of Refraction: 1.753
Molar Refractivity: 76.9±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 14.91
ACD/KOC (pH 5.5): 79.16
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 6.51
ACD/KOC (pH 7.4): 34.59
Polar Surface Area: 85 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 188.3±7.0 cm3

Click to predict properties on the Chemicalize site


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