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

1-{1-[2-(4-Chloro-1H-pyrazol-1-yl)ethyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamine

  • Molecular FormulaC9H13ClN6
  • Average mass240.693 Da
  • Monoisotopic mass240.089020 Da
  • ChemSpider ID40708752

More details:

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

1-{1-[2-(4-Chlor-1H-pyrazol-1-yl)ethyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamin [German] [ACD/IUPAC Name]
1-{1-[2-(4-Chloro-1H-pyrazol-1-yl)ethyl]-1H-1,2,3-triazol-4-yl}-N-methylmethanamine [ACD/IUPAC Name]
1-{1-[2-(4-Chloro-1H-pyrazol-1-yl)éthyl]-1H-1,2,3-triazol-4-yl}-N-méthylméthanamine [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanamine, 1-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-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: 411.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 202.7±31.5 °C
Index of Refraction: 1.673
Molar Refractivity: 63.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -1.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.40
Polar Surface Area: 61 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 169.4±7.0 cm3

Click to predict properties on the Chemicalize site


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