ChemSpider 2D Image | 2-Oxa-6-thiaspiro[3.3]heptane | C5H8OS

2-Oxa-6-thiaspiro[3.3]heptane

  • Molecular FormulaC5H8OS
  • Average mass116.181 Da
  • Monoisotopic mass116.029587 Da
  • ChemSpider ID24723516

More details:






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

2-Oxa-6-thiaspiro[3.3]heptan [German] [ACD/IUPAC Name]
2-Oxa-6-thiaspiro[3.3]heptane [ACD/Index Name] [ACD/IUPAC Name]
2-Oxa-6-thiaspiro[3.3]heptane [French] [ACD/IUPAC Name]
174-80-1 [RN]
2-oxa-6-thia-spiro[3,3]heptane
MFCD17170021

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

Density: 1.2±0.1 g/cm3
Boiling Point: 207.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.5±3.0 kJ/mol
Flash Point: 79.0±27.3 °C
Index of Refraction: 1.568
Molar Refractivity: 30.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.03
ACD/KOC (pH 5.5): 57.74
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.03
ACD/KOC (pH 7.4): 57.74
Polar Surface Area: 35 Å2
Polarizability: 12.2±0.5 10-24cm3
Surface Tension: 42.0±5.0 dyne/cm
Molar Volume: 94.4±5.0 cm3

Click to predict properties on the Chemicalize site






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