ChemSpider 2D Image | 2-{[(5-Chloro-2-thienyl)methyl]sulfanyl}-1H-benzimidazole | C12H9ClN2S2

2-{[(5-Chloro-2-thienyl)methyl]sulfanyl}-1H-benzimidazole

  • Molecular FormulaC12H9ClN2S2
  • Average mass280.796 Da
  • Monoisotopic mass279.989563 Da
  • ChemSpider ID70729290

More details:

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

1H-Benzimidazole, 2-[[(5-chloro-2-thienyl)methyl]thio]- [ACD/Index Name]
2-{[(5-Chlor-2-thienyl)methyl]sulfanyl}-1H-benzimidazol [German] [ACD/IUPAC Name]
2-{[(5-Chloro-2-thienyl)methyl]sulfanyl}-1H-benzimidazole [ACD/IUPAC Name]
2-{[(5-Chloro-2-thiényl)méthyl]sulfanyl}-1H-benzimidazole [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: 475.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 241.4±31.5 °C
Index of Refraction: 1.745
Molar Refractivity: 76.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1138.00
ACD/KOC (pH 5.5): 5165.31
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1293.42
ACD/KOC (pH 7.4): 5870.75
Polar Surface Area: 82 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 74.7±5.0 dyne/cm
Molar Volume: 188.4±5.0 cm3

Click to predict properties on the Chemicalize site


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