ChemSpider 2D Image | 1-(3-Chlorophenyl)-2-[4-hydroxy-3-(3-methoxybenzoyl)-1,1-dioxido-2H-1,2-benzothiazin-2-yl]ethanone | C24H18ClNO6S

1-(3-Chlorophenyl)-2-[4-hydroxy-3-(3-methoxybenzoyl)-1,1-dioxido-2H-1,2-benzothiazin-2-yl]ethanone

  • Molecular FormulaC24H18ClNO6S
  • Average mass483.921 Da
  • Monoisotopic mass483.054321 Da
  • ChemSpider ID30657628

More details:

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

1-(3-Chlorophenyl)-2-[4-hydroxy-3-(3-methoxybenzoyl)-1,1-dioxido-2H-1,2-benzothiazin-2-yl]ethanone [ACD/IUPAC Name]
1-(3-Chlorophényl)-2-[4-hydroxy-3-(3-méthoxybenzoyl)-1,1-dioxydo-2H-1,2-benzothiazin-2-yl]éthanone [French] [ACD/IUPAC Name]
1-(3-Chlorphenyl)-2-[4-hydroxy-3-(3-methoxybenzoyl)-1,1-dioxido-2H-1,2-benzothiazin-2-yl]ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-(3-chlorophenyl)-2-[4-hydroxy-3-(3-methoxybenzoyl)-1,1-dioxido-2H-1,2-benzothiazin-2-yl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 693.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.7±3.0 kJ/mol
Flash Point: 373.2±34.3 °C
Index of Refraction: 1.664
Molar Refractivity: 122.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.30
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 173.59
ACD/KOC (pH 5.5): 706.43
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 2.99
ACD/KOC (pH 7.4): 12.19
Polar Surface Area: 109 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 62.9±3.0 dyne/cm
Molar Volume: 330.1±3.0 cm3

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