ChemSpider 2D Image | 2-(4,5-Dichlorooctyl)-1,2-thiazol-3(2H)-one | C11H17Cl2NOS

2-(4,5-Dichlorooctyl)-1,2-thiazol-3(2H)-one

  • Molecular FormulaC11H17Cl2NOS
  • Average mass282.230 Da
  • Monoisotopic mass281.040802 Da
  • ChemSpider ID28688578

More details:






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

2-(4,5-Dichloroctyl)-1,2-thiazol-3(2H)-on [German] [ACD/IUPAC Name]
2-(4,5-Dichlorooctyl)-1,2-thiazol-3(2H)-one [ACD/IUPAC Name]
2-(4,5-Dichlorooctyl)-1,2-thiazol-3(2H)-one [French] [ACD/IUPAC Name]
3(2H)-Isothiazolone, 2-(4,5-dichlorooctyl)- [ACD/Index Name]
146345-63-3 [RN]
2-(4,5-DICHLOROOCTYL)-1,2-THIAZOL-3-ONE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 389.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 189.1±30.7 °C
Index of Refraction: 1.541
Molar Refractivity: 72.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 137.84
ACD/KOC (pH 5.5): 1182.97
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 137.84
ACD/KOC (pH 7.4): 1182.97
Polar Surface Area: 46 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 229.2±3.0 cm3

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