ChemSpider 2D Image | N-[1-(3,4-Dichlorophenyl)ethyl]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-propanamine | C17H22Cl2N2O

N-[1-(3,4-Dichlorophenyl)ethyl]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-propanamine

  • Molecular FormulaC17H22Cl2N2O
  • Average mass341.275 Da
  • Monoisotopic mass340.110931 Da
  • ChemSpider ID30707037

More details:

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

4-Isoxazolemethanamine, N-[1-(3,4-dichlorophenyl)ethyl]-3,5-dimethyl-N-propyl- [ACD/Index Name]
N-[1-(3,4-Dichlorophenyl)ethyl]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-propanamine [ACD/IUPAC Name]
N-[1-(3,4-Dichlorophényl)éthyl]-N-[(3,5-diméthyl-1,2-oxazol-4-yl)méthyl]-1-propanamine [French] [ACD/IUPAC Name]
N-[1-(3,4-Dichlorphenyl)ethyl]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-propanamin [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 417.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.0±3.0 kJ/mol
Flash Point: 206.0±27.3 °C
Index of Refraction: 1.551
Molar Refractivity: 92.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1064.81
ACD/KOC (pH 5.5): 2729.35
ACD/LogD (pH 7.4): 5.51
ACD/BCF (pH 7.4): 8781.03
ACD/KOC (pH 7.4): 22507.78
Polar Surface Area: 29 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 289.5±3.0 cm3

Click to predict properties on the Chemicalize site


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