ChemSpider 2D Image | (2R)-7,7-Dimethyl-1-(sulfanylmethyl)bicyclo[2.2.1]heptan-2-ol | C10H18OS

(2R)-7,7-Dimethyl-1-(sulfanylmethyl)bicyclo[2.2.1]heptan-2-ol

  • Molecular FormulaC10H18OS
  • Average mass186.314 Da
  • Monoisotopic mass186.107834 Da
  • ChemSpider ID60958781

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(2R)-7,7-Dimethyl-1-(sulfanylmethyl)bicyclo[2.2.1]heptan-2-ol [ACD/IUPAC Name]
(2R)-7,7-Dimethyl-1-(sulfanylmethyl)bicyclo[2.2.1]heptan-2-ol [German] [ACD/IUPAC Name]
(2R)-7,7-Diméthyl-1-(sulfanylméthyl)bicyclo[2.2.1]heptan-2-ol [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptan-2-ol, 1-(mercaptomethyl)-7,7-dimethyl-, (2R)- [ACD/Index Name]
(1S)-(-)-10-Mercaptoisoborneol
71242-58-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 270.4±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 59.0±6.0 kJ/mol
Flash Point: 117.3±19.8 °C
Index of Refraction: 1.543
Molar Refractivity: 53.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.68
ACD/KOC (pH 5.5): 626.19
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.63
ACD/KOC (pH 7.4): 625.61
Polar Surface Area: 59 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 170.5±3.0 cm3

Click to predict properties on the Chemicalize site


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