ChemSpider 2D Image | (3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-2H-1,2,6-thiadiazine-4-carboxylate 1,1-dioxide | C12H14N4O5S

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

  • Molecular FormulaC12H14N4O5S
  • Average mass326.328 Da
  • Monoisotopic mass326.068481 Da
  • ChemSpider ID44215554

More details:

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

(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-2H-1,2,6-thiadiazine-4-carboxylate 1,1-dioxide [ACD/IUPAC Name]
(3-Cyclopropyl-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-cyclopropyl-1,2,4-oxadiazol-5-yl)méthyle [French] [ACD/IUPAC Name]
2H-1,2,6-Thiadiazine-4-carboxylic acid, 2,5-dimethyl-, (3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl ester, 1,1-dioxide [ACD/Index Name]
(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1,2,6-thiadiazine-4-carboxylate
1775504-44-3 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 518.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 267.4±32.9 °C
Index of Refraction: 1.716
Molar Refractivity: 76.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.96
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.88
ACD/LogD (pH 7.4): -0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.88
Polar Surface Area: 123 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 67.8±7.0 dyne/cm
Molar Volume: 194.0±7.0 cm3

Click to predict properties on the Chemicalize site


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