ChemSpider 2D Image | 2-(Methylsulfonyl)cyclopentanethiol | C6H12O2S2

2-(Methylsulfonyl)cyclopentanethiol

  • Molecular FormulaC6H12O2S2
  • Average mass180.288 Da
  • Monoisotopic mass180.027863 Da
  • ChemSpider ID48354559

More details:






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

2-(Methylsulfonyl)cyclopentanethiol [ACD/IUPAC Name]
2-(Méthylsulfonyl)cyclopentanethiol [French] [ACD/IUPAC Name]
2-(Methylsulfonyl)cyclopentanthiol [German] [ACD/IUPAC Name]
Cyclopentanethiol, 2-(methylsulfonyl)- [ACD/Index Name]
1488902-09-5 [RN]
2-methanesulfonylcyclopentane-1-thiol
MFCD21123694

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

Density: 1.2±0.1 g/cm3
Boiling Point: 354.1±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 57.5±3.0 kJ/mol
Flash Point: 167.9±24.8 °C
Index of Refraction: 1.525
Molar Refractivity: 44.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.21
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.91
ACD/KOC (pH 5.5): 55.33
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.90
ACD/KOC (pH 7.4): 54.95
Polar Surface Area: 81 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 42.2±5.0 dyne/cm
Molar Volume: 144.8±5.0 cm3

Click to predict properties on the Chemicalize site






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