ChemSpider 2D Image | 1,2-Oxazol-3-yl methanesulfonate | C4H5NO4S

1,2-Oxazol-3-yl methanesulfonate

  • Molecular FormulaC4H5NO4S
  • Average mass163.152 Da
  • Monoisotopic mass162.993927 Da
  • ChemSpider ID24214660

More details:

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

1,2-Oxazol-3-yl methanesulfonate [ACD/IUPAC Name]
1,2-Oxazol-3-yl-methansulfonat [German] [ACD/IUPAC Name]
129235-19-4 [RN]
3-Isoxazolol, methanesulfonate (ester) [ACD/Index Name]
Méthanesulfonate de 1,2-oxazol-3-yle [French] [ACD/IUPAC Name]
3-Isoxazolol, methanesulfonate (ester) (9CI)
3-Isoxazolol,methanesulfonate(ester)(9CI)
isoxazol-3-yl methanesulfonate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 329.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.9±3.0 kJ/mol
Flash Point: 153.0±22.9 °C
Index of Refraction: 1.495
Molar Refractivity: 32.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.97
ACD/LogD (pH 7.4): -0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.97
Polar Surface Area: 78 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 110.5±3.0 cm3

Click to predict properties on the Chemicalize site


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