ChemSpider 2D Image | (1S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-thione | C10H16S

(1S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-thione

  • Molecular FormulaC10H16S
  • Average mass168.299 Da
  • Monoisotopic mass168.097275 Da
  • ChemSpider ID114393520

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-thion [German] [ACD/IUPAC Name]
(1S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-thione [ACD/IUPAC Name]
(1S,4R)-1,7,7-Triméthylbicyclo[2.2.1]heptane-2-thione [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-2-thione, 1,7,7-trimethyl-, (1S,4R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 229.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.7±3.0 kJ/mol
Flash Point: 81.7±22.6 °C
Index of Refraction: 1.542
Molar Refractivity: 51.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 81.31
ACD/KOC (pH 5.5): 810.79
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 81.31
ACD/KOC (pH 7.4): 810.79
Polar Surface Area: 32 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 39.4±5.0 dyne/cm
Molar Volume: 163.1±5.0 cm3

Click to predict properties on the Chemicalize site


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