ChemSpider 2D Image | 3-(5-Chloro-2-thienyl)-N-[(3-hydroxytetrahydro-3-thiophenyl)methyl]propanamide | C12H16ClNO2S2

3-(5-Chloro-2-thienyl)-N-[(3-hydroxytetrahydro-3-thiophenyl)methyl]propanamide

  • Molecular FormulaC12H16ClNO2S2
  • Average mass305.844 Da
  • Monoisotopic mass305.031097 Da
  • ChemSpider ID30452400

More details:

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

2-Thiophenepropanamide, 5-chloro-N-[(tetrahydro-3-hydroxy-3-thienyl)methyl]- [ACD/Index Name]
3-(5-Chlor-2-thienyl)-N-[(3-hydroxytetrahydro-3-thiophenyl)methyl]propanamid [German] [ACD/IUPAC Name]
3-(5-Chloro-2-thienyl)-N-[(3-hydroxytetrahydro-3-thiophenyl)methyl]propanamide [ACD/IUPAC Name]
3-(5-Chloro-2-thiényl)-N-[(3-hydroxytétrahydro-3-thiophényl)méthyl]propanamide [French] [ACD/IUPAC Name]
3-(5-CHLOROTHIOPHEN-2-YL)-N-[(3-HYDROXYTHIOLAN-3-YL)METHYL]PROPANAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 538.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 279.3±30.1 °C
Index of Refraction: 1.620
Molar Refractivity: 78.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 2.39
ACD/BCF (pH 5.5): 38.79
ACD/KOC (pH 5.5): 477.37
ACD/LogD (pH 7.4): 2.39
ACD/BCF (pH 7.4): 38.79
ACD/KOC (pH 7.4): 477.37
Polar Surface Area: 103 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 222.3±3.0 cm3

Click to predict properties on the Chemicalize site


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