ChemSpider 2D Image | (4-Chlorophenyl)(1,1-dioxido-4-phenyl-4H-1,4-benzothiazin-2-yl)methanone | C21H14ClNO3S

(4-Chlorophenyl)(1,1-dioxido-4-phenyl-4H-1,4-benzothiazin-2-yl)methanone

  • Molecular FormulaC21H14ClNO3S
  • Average mass395.859 Da
  • Monoisotopic mass395.038300 Da
  • ChemSpider ID22974640

More details:

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

(4-Chlorophenyl)(1,1-dioxido-4-phenyl-4H-1,4-benzothiazin-2-yl)methanone [ACD/IUPAC Name]
(4-Chlorophényl)(1,1-dioxydo-4-phényl-4H-1,4-benzothiazin-2-yl)méthanone [French] [ACD/IUPAC Name]
(4-Chlorphenyl)(1,1-dioxido-4-phenyl-4H-1,4-benzothiazin-2-yl)methanon [German] [ACD/IUPAC Name]
Methanone, (4-chlorophenyl)(1,1-dioxido-4-phenyl-4H-1,4-benzothiazin-2-yl)- [ACD/Index Name]
(4-chlorophenyl)(1,1-dioxido-4-phenyl-4H-benzo[b][1,4]thiazin-2-yl)methanone
(4-chlorophenyl)-(1,1-dioxo-4-phenyl-1λ6,4-benzothiazin-2-yl)methanone
1114659-90-3 [RN]
2-(4-chlorobenzoyl)-4-phenyl-4H-1λ6,4-benzothiazine-1,1-dione

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

Density: 1.4±0.1 g/cm3
Boiling Point: 574.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 301.0±30.1 °C
Index of Refraction: 1.681
Molar Refractivity: 105.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 794.00
ACD/KOC (pH 5.5): 4142.77
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 794.00
ACD/KOC (pH 7.4): 4142.77
Polar Surface Area: 63 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 278.3±3.0 cm3

Click to predict properties on the Chemicalize site


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