ChemSpider 2D Image | N-[5-Chloro-2-(difluoromethoxy)benzyl]-2-methyl-1-butanamine | C13H18ClF2NO

N-[5-Chloro-2-(difluoromethoxy)benzyl]-2-methyl-1-butanamine

  • Molecular FormulaC13H18ClF2NO
  • Average mass277.738 Da
  • Monoisotopic mass277.104492 Da
  • ChemSpider ID40033184

More details:

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

Benzenemethanamine, 5-chloro-2-(difluoromethoxy)-N-(2-methylbutyl)- [ACD/Index Name]
N-[5-Chlor-2-(difluormethoxy)benzyl]-2-methyl-1-butanamin [German] [ACD/IUPAC Name]
N-[5-Chloro-2-(difluoromethoxy)benzyl]-2-methyl-1-butanamine [ACD/IUPAC Name]
N-[5-Chloro-2-(difluorométhoxy)benzyl]-2-méthyl-1-butanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 307.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 139.7±26.5 °C
Index of Refraction: 1.482
Molar Refractivity: 69.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.08
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 5.95
ACD/KOC (pH 7.4): 41.68
Polar Surface Area: 21 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 244.7±3.0 cm3

Click to predict properties on the Chemicalize site


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