Found 12 results

Search term: MF = 'C_{22}H_{13}Cl_{2}FN_{2}OS_{2}'
ChemSpider 2D Image | 2-({6-[(E)-(2,6-Dichlorobenzylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(4-fluorophenyl)ethanone | C22H13Cl2FN2OS2

2-({6-[(E)-(2,6-Dichlorobenzylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(4-fluorophenyl)ethanone

  • Molecular FormulaC22H13Cl2FN2OS2
  • Average mass475.386 Da
  • Monoisotopic mass473.983032 Da
  • ChemSpider ID57296997

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({6-[(E)-(2,6-Dichlorbenzyliden)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(4-fluorphenyl)ethanon [German] [ACD/IUPAC Name]
2-({6-[(E)-(2,6-Dichlorobenzylidene)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(4-fluorophenyl)ethanone [ACD/IUPAC Name]
2-({6-[(E)-(2,6-Dichlorobenzylidène)amino]-1,3-benzothiazol-2-yl}sulfanyl)-1-(4-fluorophényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[[6-[[(1E)-(2,6-dichlorophenyl)methylene]amino]-2-benzothiazolyl]thio]-1-(4-fluorophenyl)- [ACD/Index Name]
2-[[6-[(2,6-DICHLOROPHENYL)METHYLIDENEAMINO]-1,3-BENZOTHIAZOL-2-YL]SULFANYL]-1-(4-FLUOROPHENYL)ETHANONE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 643.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.7±34.3 °C
Index of Refraction: 1.686
Molar Refractivity: 125.4±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.26
ACD/BCF (pH 5.5): 33450.06
ACD/KOC (pH 5.5): 60274.78
ACD/LogD (pH 7.4): 6.26
ACD/BCF (pH 7.4): 33453.14
ACD/KOC (pH 7.4): 60280.34
Polar Surface Area: 96 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 329.7±7.0 cm3

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