ChemSpider 2D Image | 4-Methylphenyl 4-ethyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide | C17H18N2O4S

4-Methylphenyl 4-ethyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide

  • Molecular FormulaC17H18N2O4S
  • Average mass346.401 Da
  • Monoisotopic mass346.098724 Da
  • ChemSpider ID26948330

More details:

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

1,1-Dioxyde de 4-éthyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate de 4-méthylphényle [French] [ACD/IUPAC Name]
2H-1,2,4-Benzothiadiazine-7-carboxylic acid, 4-ethyl-3,4-dihydro-, 4-methylphenyl ester, 1,1-dioxide [ACD/Index Name]
4-Methylphenyl 4-ethyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide [ACD/IUPAC Name]
4-Methylphenyl-4-ethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 552.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 288.0±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 90.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.27
ACD/KOC (pH 5.5): 968.66
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 101.39
ACD/KOC (pH 7.4): 941.93
Polar Surface Area: 84 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 267.2±3.0 cm3

Click to predict properties on the Chemicalize site


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