ChemSpider 2D Image | 3-Methylphenyl 4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide | C16H16N2O4S

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

  • Molecular FormulaC16H16N2O4S
  • Average mass332.374 Da
  • Monoisotopic mass332.083069 Da
  • ChemSpider ID26948328

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 3-méthylphényle [French] [ACD/IUPAC Name]
2H-1,2,4-Benzothiadiazine-7-carboxylic acid, 3,4-dihydro-4-methyl-, 3-methylphenyl ester, 1,1-dioxide [ACD/Index Name]
3-Methylphenyl 4-methyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-carboxylate 1,1-dioxide [ACD/IUPAC Name]
3-Methylphenyl-4-methyl-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: 543.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.5±32.9 °C
Index of Refraction: 1.606
Molar Refractivity: 86.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 62.10
ACD/KOC (pH 5.5): 668.41
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.41
ACD/KOC (pH 7.4): 650.22
Polar Surface Area: 84 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 249.6±3.0 cm3

Click to predict properties on the Chemicalize site


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