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Search term: QFFMTTQDIZRKLJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Methyl-2-propyl-1,3-oxathiane | C8H16OS

4-Methyl-2-propyl-1,3-oxathiane

  • Molecular FormulaC8H16OS
  • Average mass160.277 Da
  • Monoisotopic mass160.092178 Da
  • ChemSpider ID26233398

More details:

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

1,3-Oxathiane, 4-methyl-2-propyl- [ACD/Index Name]
1064678-08-5 [RN]
20177282 [Beilstein]
4-Methyl-2-propyl-1,3-oxathian [German] [ACD/IUPAC Name]
4-Methyl-2-propyl-1,3-oxathiane [ACD/IUPAC Name]
4-Méthyl-2-propyl-1,3-oxathiane [French] [ACD/IUPAC Name]
T6O CSTJ B3 D1 [WLN]
FEMA 4677
UNII-AYG5B4GG7B

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

Density: 0.9±0.1 g/cm3
Boiling Point: 226.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.4±3.0 kJ/mol
Flash Point: 90.8±25.4 °C
Index of Refraction: 1.460
Molar Refractivity: 46.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 42.42
ACD/KOC (pH 5.5): 508.89
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 42.42
ACD/KOC (pH 7.4): 508.89
Polar Surface Area: 35 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 171.0±3.0 cm3

Click to predict properties on the Chemicalize site


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