ChemSpider 2D Image | 1-[2-(3,4-Dichlorophenoxy)-4-fluorophenyl]-N-methylmethanamine | C14H12Cl2FNO

1-[2-(3,4-Dichlorophenoxy)-4-fluorophenyl]-N-methylmethanamine

  • Molecular FormulaC14H12Cl2FNO
  • Average mass300.156 Da
  • Monoisotopic mass299.027985 Da
  • ChemSpider ID23332482

More details:

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

1-[2-(3,4-Dichlorophenoxy)-4-fluorophenyl]-N-methylmethanamine [ACD/IUPAC Name]
1-[2-(3,4-Dichlorophénoxy)-4-fluorophényl]-N-méthylméthanamine [French] [ACD/IUPAC Name]
1-[2-(3,4-Dichlorphenoxy)-4-fluorphenyl]-N-methylmethanamin [German] [ACD/IUPAC Name]
Benzenemethanamine, 2-(3,4-dichlorophenoxy)-4-fluoro-N-methyl- [ACD/Index Name]
1-(2-(3,4-dichlorophenoxy)-4-fluorophenyl)-N-methylmethanamine
CHEMBL487223
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL487223/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 357.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.3±3.0 kJ/mol
Flash Point: 170.2±27.9 °C
Index of Refraction: 1.572
Molar Refractivity: 75.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 4.51
ACD/KOC (pH 5.5): 15.13
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 120.37
ACD/KOC (pH 7.4): 403.78
Polar Surface Area: 21 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 229.8±3.0 cm3

Click to predict properties on the Chemicalize site


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