ChemSpider 2D Image | 4-[(4-Chloro-2,6-dimethylphenoxy)methyl]-1,3-thiazol-2-amine | C12H13ClN2OS

4-[(4-Chloro-2,6-dimethylphenoxy)methyl]-1,3-thiazol-2-amine

  • Molecular FormulaC12H13ClN2OS
  • Average mass268.762 Da
  • Monoisotopic mass268.043701 Da
  • ChemSpider ID38073060

More details:






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

2-Thiazolamine, 4-[(4-chloro-2,6-dimethylphenoxy)methyl]- [ACD/Index Name]
4-[(4-Chlor-2,6-dimethylphenoxy)methyl]-1,3-thiazol-2-amin [German] [ACD/IUPAC Name]
4-[(4-Chloro-2,6-dimethylphenoxy)methyl]-1,3-thiazol-2-amine [ACD/IUPAC Name]
4-[(4-Chloro-2,6-diméthylphénoxy)méthyl]-1,3-thiazol-2-amine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 431.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 214.5±27.3 °C
Index of Refraction: 1.632
Molar Refractivity: 72.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.56
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 232.79
ACD/KOC (pH 5.5): 1718.27
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 234.27
ACD/KOC (pH 7.4): 1729.19
Polar Surface Area: 76 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 203.6±3.0 cm3

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