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

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

  • Molecular FormulaC17H18N2O5S
  • Average mass362.400 Da
  • Monoisotopic mass362.093628 Da
  • ChemSpider ID26948338

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 3-méthoxyphényle [French] [ACD/IUPAC Name]
2H-1,2,4-Benzothiadiazine-7-carboxylic acid, 4-ethyl-3,4-dihydro-, 3-methoxyphenyl ester, 1,1-dioxide [ACD/Index Name]
3-Methoxyphenyl 4-ethyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide [ACD/IUPAC Name]
3-Methoxyphenyl-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: 580.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.6±32.9 °C
Index of Refraction: 1.588
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: 2.43
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 44.32
ACD/KOC (pH 5.5): 525.06
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.06
ACD/KOC (pH 7.4): 510.06
Polar Surface Area: 93 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 274.9±3.0 cm3

Click to predict properties on the Chemicalize site


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