ChemSpider 2D Image | N-(1,1-Dioxidotetrahydro-2H-thiopyran-3-yl)-4-sulfanyl-2-thiophenecarboxamide | C10H13NO3S3

N-(1,1-Dioxidotetrahydro-2H-thiopyran-3-yl)-4-sulfanyl-2-thiophenecarboxamide

  • Molecular FormulaC10H13NO3S3
  • Average mass291.410 Da
  • Monoisotopic mass291.005768 Da
  • ChemSpider ID55404235

More details:

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

2-Thiophenecarboxamide, 4-mercapto-N-(tetrahydro-1,1-dioxido-2H-thiopyran-3-yl)- [ACD/Index Name]
N-(1,1-Dioxidotetrahydro-2H-thiopyran-3-yl)-4-sulfanyl-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-(1,1-Dioxidotetrahydro-2H-thiopyran-3-yl)-4-sulfanyl-2-thiophenecarboxamide [ACD/IUPAC Name]
N-(1,1-Dioxydotétrahydro-2H-thiopyrane-3-yl)-4-sulfanyl-2-thiophènecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 584.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.4±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 71.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.58
ACD/KOC (pH 5.5): 42.36
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.48
Polar Surface Area: 139 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 199.0±5.0 cm3

Click to predict properties on the Chemicalize site


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