ChemSpider 2D Image | 4-(1,4-Dithiepan-6-yl)-2,2-dimethylmorpholine | C11H21NOS2

4-(1,4-Dithiepan-6-yl)-2,2-dimethylmorpholine

  • Molecular FormulaC11H21NOS2
  • Average mass247.421 Da
  • Monoisotopic mass247.106461 Da
  • ChemSpider ID59708244

More details:






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

4-(1,4-Dithiepan-6-yl)-2,2-dimethylmorpholin [German] [ACD/IUPAC Name]
4-(1,4-Dithiepan-6-yl)-2,2-dimethylmorpholine [ACD/IUPAC Name]
4-(1,4-Dithiépan-6-yl)-2,2-diméthylmorpholine [French] [ACD/IUPAC Name]
Morpholine, 4-(1,4-dithiepan-6-yl)-2,2-dimethyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 352.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.7±3.0 kJ/mol
Flash Point: 167.0±27.9 °C
Index of Refraction: 1.541
Molar Refractivity: 70.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 3.94
ACD/KOC (pH 5.5): 56.41
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.51
ACD/KOC (pH 7.4): 307.79
Polar Surface Area: 63 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 223.8±3.0 cm3

Click to predict properties on the Chemicalize site






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