ChemSpider 2D Image | N-[(2E)-3-Allyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-chloroacetamide | C10H13ClN2O3S2

N-[(2E)-3-Allyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-chloroacetamide

  • Molecular FormulaC10H13ClN2O3S2
  • Average mass308.805 Da
  • Monoisotopic mass308.005615 Da
  • ChemSpider ID21478426
  • Double-bond stereo - Double-bond stereo


More details:






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

Acetamide, 2-chloro-N-[(2E)-tetrahydro-5,5-dioxido-3-(2-propen-1-yl)thieno[3,4-d]thiazol-2(3H)-ylidene]- [ACD/Index Name]
N-[(2E)-3-Allyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-yliden]-2-chloracetamid [German] [ACD/IUPAC Name]
N-[(2E)-3-Allyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-chloroacetamide [ACD/IUPAC Name]
N-[(2E)-3-Allyl-5,5-dioxydotétrahydrothiéno[3,4-d][1,3]thiazol-2(3H)-ylidène]-2-chloroacétamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 516.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 266.3±32.9 °C
Index of Refraction: 1.687
Molar Refractivity: 73.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.56
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.55
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.55
Polar Surface Area: 100 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 62.8±7.0 dyne/cm
Molar Volume: 192.7±7.0 cm3

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