ChemSpider 2D Image | Methyl 4-(3-ethylphenyl)-7-fluoro-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide | C18H16FNO4S

Methyl 4-(3-ethylphenyl)-7-fluoro-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide

  • Molecular FormulaC18H16FNO4S
  • Average mass361.387 Da
  • Monoisotopic mass361.078400 Da
  • ChemSpider ID25184612

More details:

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

1,1-Dioxyde de 4-(3-éthylphényl)-7-fluoro-4H-1,4-benzothiazine-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-1,4-Benzothiazine-2-carboxylic acid, 4-(3-ethylphenyl)-7-fluoro-, methyl ester, 1,1-dioxide [ACD/Index Name]
Methyl 4-(3-ethylphenyl)-7-fluoro-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Methyl-4-(3-ethylphenyl)-7-fluor-4H-1,4-benzothiazin-2-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
1291855-96-3 [RN]
4-(3-Ethyl-phenyl)-7-fluoro-1,1-dioxo-1,4-dihydro-1λ*6*-benzo[1,4]thiazine-2-carboxylic acid methyl ester
methyl 4-(3-ethylphenyl)-7-fluoro-1,1-dioxo-4H-1λ6,4-benzothiazine-2-carboxylate
methyl 4-(3-ethylphenyl)-7-fluoro-4H-benzo[b][1,4]thiazine-2-carboxylate 1,1-dioxide
MFCD18788343

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

Density: 1.4±0.1 g/cm3
Boiling Point: 529.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 273.9±30.1 °C
Index of Refraction: 1.610
Molar Refractivity: 91.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 133.98
ACD/KOC (pH 5.5): 1159.16
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 133.98
ACD/KOC (pH 7.4): 1159.16
Polar Surface Area: 72 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 264.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement