ChemSpider 2D Image | (5E)-2-[3-(2,2-Dichlorovinyl)-2,2-dimethylcyclopropyl]-5-[(3-methyl-2-thienyl)methylene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one | C17H15Cl2N3OS2

(5E)-2-[3-(2,2-Dichlorovinyl)-2,2-dimethylcyclopropyl]-5-[(3-methyl-2-thienyl)methylene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

  • Molecular FormulaC17H15Cl2N3OS2
  • Average mass412.357 Da
  • Monoisotopic mass411.003357 Da
  • ChemSpider ID21817296

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-2-[3-(2,2-Dichlorovinyl)-2,2-dimethylcyclopropyl]-5-[(3-methyl-2-thienyl)methylene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one [ACD/IUPAC Name]
(5E)-2-[3-(2,2-Dichlorovinyl)-2,2-diméthylcyclopropyl]-5-[(3-méthyl-2-thiényl)méthylène][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one [French] [ACD/IUPAC Name]
(5E)-2-[3-(2,2-Dichlorvinyl)-2,2-dimethylcyclopropyl]-5-[(3-methyl-2-thienyl)methylen][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-on [German] [ACD/IUPAC Name]
Thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 2-[3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropyl]-5-[(3-methyl-2-thienyl)methylene]-, (5E)- [ACD/Index Name]
2-[3-(2,2-Dichloro-vinyl)-2,2-dimethyl-cyclopropyl]-5-(3-methyl-thiophen-2-ylmethylene)-thiazolo[3,2-b][1,2,4]triazol-6-one

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

Density: 1.6±0.1 g/cm3
Boiling Point: 563.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 294.5±32.9 °C
Index of Refraction: 1.754
Molar Refractivity: 106.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.97
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20154.98
ACD/KOC (pH 5.5): 41943.34
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20154.98
ACD/KOC (pH 7.4): 41943.34
Polar Surface Area: 101 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 58.7±7.0 dyne/cm
Molar Volume: 260.1±7.0 cm3

Click to predict properties on the Chemicalize site


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