ChemSpider 2D Image | 1-(3,4-Dichlorophenyl)-3-methoxy-N-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-propanamine | C14H18Cl2N4O

1-(3,4-Dichlorophenyl)-3-methoxy-N-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-propanamine

  • Molecular FormulaC14H18Cl2N4O
  • Average mass329.225 Da
  • Monoisotopic mass328.085754 Da
  • ChemSpider ID65051374

More details:

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

1-(3,4-Dichlorophenyl)-3-methoxy-N-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-propanamine [ACD/IUPAC Name]
1-(3,4-Dichlorophényl)-3-méthoxy-N-[(4-méthyl-4H-1,2,4-triazol-3-yl)méthyl]-1-propanamine [French] [ACD/IUPAC Name]
1-(3,4-Dichlorphenyl)-3-methoxy-N-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-propanamin [German] [ACD/IUPAC Name]
4H-1,2,4-Triazole-3-methanamine, N-[1-(3,4-dichlorophenyl)-3-methoxypropyl]-4-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 484.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 246.8±31.5 °C
Index of Refraction: 1.600
Molar Refractivity: 85.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.39
ACD/BCF (pH 5.5): 34.35
ACD/KOC (pH 5.5): 381.48
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.21
ACD/KOC (pH 7.4): 613.20
Polar Surface Area: 52 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 249.3±7.0 cm3

Click to predict properties on the Chemicalize site


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