ChemSpider 2D Image | 4-Chloro-N-[(3-methyl-1,2,3-triazolidin-4-yl)methyl]-1H-pyrazole-3-carboxamide | C8H13ClN6O

4-Chloro-N-[(3-methyl-1,2,3-triazolidin-4-yl)methyl]-1H-pyrazole-3-carboxamide

  • Molecular FormulaC8H13ClN6O
  • Average mass244.681 Da
  • Monoisotopic mass244.083939 Da
  • ChemSpider ID111203938

More details:

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

1H-Pyrazole-3-carboxamide, 4-chloro-N-[(3-methyl-1,2,3-triazolidin-4-yl)methyl]- [ACD/Index Name]
4-Chlor-N-[(3-methyl-1,2,3-triazolidin-4-yl)methyl]-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
4-Chloro-N-[(3-methyl-1,2,3-triazolidin-4-yl)methyl]-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
4-Chloro-N-[(3-méthyl-1,2,3-triazolidin-4-yl)méthyl]-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.571
Molar Refractivity: 59.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.33
ACD/LogD (pH 5.5): -4.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 181.1±3.0 cm3

Click to predict properties on the Chemicalize site


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