ChemSpider 2D Image | Triclosan Methyl-d3 Ether | C13H6D3Cl3O2

Triclosan Methyl-d3 Ether

  • Molecular FormulaC13H6D3Cl3O2
  • Average mass306.587 Da
  • Monoisotopic mass304.985657 Da
  • ChemSpider ID34998271

  • Non-standard isotope - Non-standard isotope

More details:

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

1020720-00-6 [RN]
2,4-Dichlor-1-(4-chlor-2-methoxyphenoxy)(2H3)benzol [German] [ACD/IUPAC Name]
2,4-Dichloro-1-(4-chloro-2-methoxyphenoxy)(2H3)benzene [ACD/IUPAC Name]
2,4-Dichloro-1-(4-chloro-2-méthoxyphénoxy)(2H3)benzène [French] [ACD/IUPAC Name]
Benzene-1,2,4-d3, 3,5-dichloro-6-(4-chloro-2-methoxyphenoxy)- [ACD/Index Name]
Triclosan Methyl-d3 Ether
Triclosan Methyl-d3Ether

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

Density: 1.4±0.1 g/cm3
Boiling Point: 358.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 128.5±28.0 °C
Index of Refraction: 1.589
Molar Refractivity: 74.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 5.52
ACD/BCF (pH 5.5): 9160.68
ACD/KOC (pH 5.5): 23852.71
ACD/LogD (pH 7.4): 5.52
ACD/BCF (pH 7.4): 9160.68
ACD/KOC (pH 7.4): 23852.71
Polar Surface Area: 18 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 219.9±3.0 cm3

Click to predict properties on the Chemicalize site


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