ChemSpider 2D Image | (3,4-Dimethoxyphenyl)[4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl]methanone | C25H22FNO5S

(3,4-Dimethoxyphenyl)[4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl]methanone

  • Molecular FormulaC25H22FNO5S
  • Average mass467.509 Da
  • Monoisotopic mass467.120270 Da
  • ChemSpider ID22974926

More details:

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

(3,4-Dimethoxyphenyl)[4-(3,5-dimethylphenyl)-6-fluor-1,1-dioxido-4H-1,4-benzothiazin-2-yl]methanon [German] [ACD/IUPAC Name]
(3,4-Dimethoxyphenyl)[4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl]methanone [ACD/IUPAC Name]
(3,4-Diméthoxyphényl)[4-(3,5-diméthylphényl)-6-fluoro-1,1-dioxydo-4H-1,4-benzothiazin-2-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, (3,4-dimethoxyphenyl)[4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl]- [ACD/Index Name]
(3,4-dimethoxyphenyl)(4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxido-4H-benzo[b][1,4]thiazin-2-yl)methanone
(3,4-dimethoxyphenyl)-[4-(3,5-dimethylphenyl)-6-fluoro-1,1-dioxo-1λ6,4-benzothiazin-2-yl]methanone
1114853-35-8 [RN]
2-(3,4-dimethoxybenzoyl)-4-(3,5-dimethylphenyl)-6-fluoro-4H-1λ6,4-benzothiazine-1,1-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 652.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.1±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 122.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1719.03
ACD/KOC (pH 5.5): 7201.34
ACD/LogD (pH 7.4): 4.56
ACD/BCF (pH 7.4): 1719.03
ACD/KOC (pH 7.4): 7201.34
Polar Surface Area: 81 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 351.1±3.0 cm3

Click to predict properties on the Chemicalize site


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