ChemSpider 2D Image | Isocyanato(methylsulfonyl)methane | C3H5NO3S

Isocyanato(methylsulfonyl)methane

  • Molecular FormulaC3H5NO3S
  • Average mass135.142 Da
  • Monoisotopic mass134.999008 Da
  • ChemSpider ID26699955

More details:

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

1161826-12-5 [RN]
isocyanato(methanesulfonyl)methane
Isocyanato(methylsulfonyl)methan [German] [ACD/IUPAC Name]
Isocyanato(methylsulfonyl)methane [ACD/IUPAC Name]
Isocyanato(méthylsulfonyl)méthane [French] [ACD/IUPAC Name]
Methane, isocyanato(methylsulfonyl)- [ACD/Index Name]
MFCD19632225

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

Density: 1.3±0.1 g/cm3
Boiling Point: 287.0±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.6±3.0 kJ/mol
Flash Point: 127.4±22.6 °C
Index of Refraction: 1.497
Molar Refractivity: 29.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.11
ACD/LogD (pH 5.5): -0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.77
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.77
Polar Surface Area: 72 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 101.9±7.0 cm3

Click to predict properties on the Chemicalize site


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