ChemSpider 2D Image | 2-Ethoxyphenyl 4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide | C17H18N2O5S

2-Ethoxyphenyl 4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide

  • Molecular FormulaC17H18N2O5S
  • Average mass362.400 Da
  • Monoisotopic mass362.093628 Da
  • ChemSpider ID26948340

More details:

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

1,1-Dioxyde de 4-méthyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate de 2-éthoxyphényle [French] [ACD/IUPAC Name]
2-Ethoxyphenyl 4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide [ACD/IUPAC Name]
2-Ethoxyphenyl-4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
2H-1,2,4-Benzothiadiazine-7-carboxylic acid, 3,4-dihydro-4-methyl-, 2-ethoxyphenyl ester, 1,1-dioxide [ACD/Index 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: 596.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.8±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 92.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.71
ACD/KOC (pH 5.5): 422.46
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.78
ACD/KOC (pH 7.4): 410.49
Polar Surface Area: 93 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 273.8±3.0 cm3

Click to predict properties on the Chemicalize site


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