ChemSpider 2D Image | 2-(3,4-Dichlorophenoxy)-N-methyl-N-[(1-methyl-1H-1,2,4-triazol-5-yl)methyl]-1-propanamine | C14H18Cl2N4O

2-(3,4-Dichlorophenoxy)-N-methyl-N-[(1-methyl-1H-1,2,4-triazol-5-yl)methyl]-1-propanamine

  • Molecular FormulaC14H18Cl2N4O
  • Average mass329.225 Da
  • Monoisotopic mass328.085754 Da
  • ChemSpider ID35192314

More details:

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

1H-1,2,4-Triazole-5-methanamine, N-[2-(3,4-dichlorophenoxy)propyl]-N,1-dimethyl- [ACD/Index Name]
2-(3,4-Dichlorophenoxy)-N-methyl-N-[(1-methyl-1H-1,2,4-triazol-5-yl)methyl]-1-propanamine [ACD/IUPAC Name]
2-(3,4-Dichlorophénoxy)-N-méthyl-N-[(1-méthyl-1H-1,2,4-triazol-5-yl)méthyl]-1-propanamine [French] [ACD/IUPAC Name]
2-(3,4-Dichlorphenoxy)-N-methyl-N-[(1-methyl-1H-1,2,4-triazol-5-yl)methyl]-1-propanamin [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 470.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 238.5±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 86.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 18.63
ACD/KOC (pH 5.5): 161.16
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 124.27
ACD/KOC (pH 7.4): 1075.11
Polar Surface Area: 43 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 41.9±7.0 dyne/cm
Molar Volume: 254.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement