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Search term: MF = 'C_{13}H_{26}O_{2}S'
ChemSpider 2D Image | Cyclododecyl methanesulfinate | C13H26O2S

Cyclododecyl methanesulfinate

  • Molecular FormulaC13H26O2S
  • Average mass246.409 Da
  • Monoisotopic mass246.165344 Da
  • ChemSpider ID28681973

More details:

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

Cyclododecyl methanesulfinate [ACD/IUPAC Name]
Cyclododecyl-methansulfinat [German] [ACD/IUPAC Name]
Méthanesulfinate de cyclododécyle [French] [ACD/IUPAC Name]
Methanesulfinic acid, cyclododecyl ester [ACD/Index Name]
135802-74-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 361.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 172.2±23.2 °C
Index of Refraction: 1.497
Molar Refractivity: 70.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1024.52
ACD/KOC (pH 5.5): 4971.98
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1024.52
ACD/KOC (pH 7.4): 4971.98
Polar Surface Area: 46 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 241.8±5.0 cm3

Click to predict properties on the Chemicalize site


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