ChemSpider 2D Image | 1-{1-[(5-Chloro-1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamine | C9H13ClN6

1-{1-[(5-Chloro-1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamine

  • Molecular FormulaC9H13ClN6
  • Average mass240.693 Da
  • Monoisotopic mass240.089020 Da
  • ChemSpider ID68997280

More details:

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

1-{1-[(5-Chlor-1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamin [German] [ACD/IUPAC Name]
1-{1-[(5-Chloro-1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamine [ACD/IUPAC Name]
1-{1-[(5-Chloro-1-méthyl-1H-imidazol-2-yl)méthyl]-1H-1,2,3-triazol-4-yl}-N-méthylméthanamine [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanamine, 1-[(5-chloro-1-methyl-1H-imidazol-2-yl)methyl]-N-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 451.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 226.7±31.5 °C
Index of Refraction: 1.675
Molar Refractivity: 63.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.79
ACD/LogD (pH 5.5): -1.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.16
Polar Surface Area: 61 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 168.5±7.0 cm3

Click to predict properties on the Chemicalize site


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