ChemSpider 2D Image | 2-(Methoxymethyl)-1,3-dithiepane 1,1,3,3-tetraoxide | C7H14O5S2

2-(Methoxymethyl)-1,3-dithiepane 1,1,3,3-tetraoxide

  • Molecular FormulaC7H14O5S2
  • Average mass242.313 Da
  • Monoisotopic mass242.028259 Da
  • ChemSpider ID21131473

More details:

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

1,1,3,3-Tétraoxyde de 2-(méthoxyméthyl)-1,3-dithiépane [French] [ACD/IUPAC Name]
1,3-Dithiepane, 2-(methoxymethyl)-, 1,1,3,3-tetraoxide [ACD/Index Name]
2-(Methoxymethyl)-1,3-dithiepan-1,1,3,3-tetraoxid [German] [ACD/IUPAC Name]
2-(Methoxymethyl)-1,3-dithiepane 1,1,3,3-tetraoxide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 517.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 266.7±25.9 °C
Index of Refraction: 1.483
Molar Refractivity: 51.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.80
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.32
ACD/LogD (pH 7.4): -1.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.32
Polar Surface Area: 94 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

Click to predict properties on the Chemicalize site


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