ChemSpider 2D Image | (3-Methyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-2H-1,2,6-thiadiazine-4-carboxylate 1,1-dioxide | C10H12N4O5S

(3-Methyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-2H-1,2,6-thiadiazine-4-carboxylate 1,1-dioxide

  • Molecular FormulaC10H12N4O5S
  • Average mass300.291 Da
  • Monoisotopic mass300.052826 Da
  • ChemSpider ID44225999

More details:

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

(3-Methyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-2H-1,2,6-thiadiazine-4-carboxylate 1,1-dioxide [ACD/IUPAC Name]
(3-Methyl-1,2,4-oxadiazol-5-yl)methyl-2,5-dimethyl-2H-1,2,6-thiadiazin-4-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
1,1-Dioxyde de 2,5-diméthyl-2H-1,2,6-thiadiazine-4-carboxylate de (3-méthyl-1,2,4-oxadiazol-5-yl)méthyle [French] [ACD/IUPAC Name]
2H-1,2,6-Thiadiazine-4-carboxylic acid, 2,5-dimethyl-, (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester, 1,1-dioxide [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 483.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.4±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 69.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.93
ACD/LogD (pH 5.5): -0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.45
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.45
Polar Surface Area: 123 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 59.7±7.0 dyne/cm
Molar Volume: 189.5±7.0 cm3

Click to predict properties on the Chemicalize site


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