ChemSpider 2D Image | 3,6,9-Trioxa-12-thiahexadecan-1-ol | C12H26O4S

3,6,9-Trioxa-12-thiahexadecan-1-ol

  • Molecular FormulaC12H26O4S
  • Average mass266.397 Da
  • Monoisotopic mass266.155182 Da
  • ChemSpider ID28670807

More details:

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

3,6,9-Trioxa-12-thiahexadecan-1-ol [German] [ACD/Index Name] [ACD/IUPAC Name]
3,6,9-Trioxa-12-thiahexadecan-1-ol [ACD/Index Name] [ACD/IUPAC Name]
3,6,9-Trioxa-12-thiahexadécan-1-ol [French] [ACD/IUPAC Name]
111290-06-3 [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: 372.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.7±6.0 kJ/mol
Flash Point: 179.0±25.1 °C
Index of Refraction: 1.475
Molar Refractivity: 72.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 7.32
ACD/KOC (pH 5.5): 144.72
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 7.32
ACD/KOC (pH 7.4): 144.72
Polar Surface Area: 73 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 257.2±3.0 cm3

Click to predict properties on the Chemicalize site


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