ChemSpider 2D Image | 5-(3,5-Dichloro-2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-one | C7H4Cl2N4O

5-(3,5-Dichloro-2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

  • Molecular FormulaC7H4Cl2N4O
  • Average mass231.039 Da
  • Monoisotopic mass229.976212 Da
  • ChemSpider ID36138539

More details:

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

3H-1,2,4-Triazol-3-one, 5-(3,5-dichloro-2-pyridinyl)-2,4-dihydro- [ACD/Index Name]
5-(3,5-Dichlor-2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
5-(3,5-Dichloro-2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
5-(3,5-Dichloro-2-pyridinyl)-2,4-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.787
Molar Refractivity: 52.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.42
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 2.66
ACD/KOC (pH 5.5): 68.44
ACD/LogD (pH 7.4): 0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.78
Polar Surface Area: 66 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 71.3±7.0 dyne/cm
Molar Volume: 123.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement