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Search term: IOWQEEJNRMHSHM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Chloro-1-methyl-3-(4-methyl-1-piperazinyl)-1H-pyrazol-5-amine | C9H16ClN5

4-Chloro-1-methyl-3-(4-methyl-1-piperazinyl)-1H-pyrazol-5-amine

  • Molecular FormulaC9H16ClN5
  • Average mass229.710 Da
  • Monoisotopic mass229.109421 Da
  • ChemSpider ID45707033

More details:

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

1H-Pyrazol-5-amine, 4-chloro-1-methyl-3-(4-methyl-1-piperazinyl)- [ACD/Index Name]
4-Chlor-1-methyl-3-(4-methyl-1-piperazinyl)-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
4-Chloro-1-methyl-3-(4-methyl-1-piperazinyl)-1H-pyrazol-5-amine [ACD/IUPAC Name]
4-Chloro-1-méthyl-3-(4-méthyl-1-pipérazinyl)-1H-pyrazol-5-amine [French] [ACD/IUPAC Name]
1782780-53-3 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 396.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.7±3.0 kJ/mol
Flash Point: 193.5±27.9 °C
Index of Refraction: 1.663
Molar Refractivity: 60.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.02
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.25
ACD/KOC (pH 7.4): 80.06
Polar Surface Area: 50 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 161.9±7.0 cm3

Click to predict properties on the Chemicalize site


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