ChemSpider 2D Image | 3-Oxetanyl 4-methylbenzenesulfonate | C10H12O4S

3-Oxetanyl 4-methylbenzenesulfonate

  • Molecular FormulaC10H12O4S
  • Average mass228.265 Da
  • Monoisotopic mass228.045624 Da
  • ChemSpider ID19623695

More details:

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

26272-83-3 [RN]
3-Oxetanol, 4-methylbenzenesulfonate [ACD/Index Name]
3-Oxetanyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
3-Oxetanyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
4-Méthylbenzènesulfonate de 3-oxétanyle [French] [ACD/IUPAC Name]
Oxetan-3-yl 4-methylbenzene-1-sulfonate
oxetan-3-yl 4-methylbenzenesulfonate
3-(tosyloxy)oxetane
3430-23-7 [RN]
3-Oxetanyl p-toluenesulfonate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 371.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 178.5±25.9 °C
Index of Refraction: 1.568
Molar Refractivity: 55.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.79
ACD/KOC (pH 5.5): 164.97
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.79
ACD/KOC (pH 7.4): 164.97
Polar Surface Area: 61 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 169.6±5.0 cm3

Click to predict properties on the Chemicalize site


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