ChemSpider 2D Image | 7,7-Dimethyl-N-(6-oxa-2-thiaspiro[4.5]dec-9-yl)-1,4-thiazepane-4-carboxamide | C16H28N2O2S2

7,7-Dimethyl-N-(6-oxa-2-thiaspiro[4.5]dec-9-yl)-1,4-thiazepane-4-carboxamide

  • Molecular FormulaC16H28N2O2S2
  • Average mass344.536 Da
  • Monoisotopic mass344.159210 Da
  • ChemSpider ID62276457

More details:

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

1,4-Thiazepine-4(5H)-carboxamide, tetrahydro-7,7-dimethyl-N-6-oxa-2-thiaspiro[4.5]dec-9-yl- [ACD/Index Name]
7,7-Dimethyl-N-(6-oxa-2-thiaspiro[4.5]dec-9-yl)-1,4-thiazepan-4-carboxamid [German] [ACD/IUPAC Name]
7,7-Dimethyl-N-(6-oxa-2-thiaspiro[4.5]dec-9-yl)-1,4-thiazepane-4-carboxamide [ACD/IUPAC Name]
7,7-Diméthyl-N-(6-oxa-2-thiaspiro[4.5]déc-9-yl)-1,4-thiazépane-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 565.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.0±3.0 kJ/mol
Flash Point: 296.1±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 95.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 110.13
ACD/KOC (pH 5.5): 1007.38
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 110.12
ACD/KOC (pH 7.4): 1007.37
Polar Surface Area: 92 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 282.5±5.0 cm3

Click to predict properties on the Chemicalize site


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