ChemSpider 2D Image | 7-Chloro-4-oxo-9-(4H-1,2,4-triazol-4-yl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid | C12H6ClN7O3

7-Chloro-4-oxo-9-(4H-1,2,4-triazol-4-yl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid

  • Molecular FormulaC12H6ClN7O3
  • Average mass331.674 Da
  • Monoisotopic mass331.022064 Da
  • ChemSpider ID129201809

More details:

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

[1,2,4]Triazolo[1,5-a]quinoxaline-2-carboxylic acid, 7-chloro-4,5-dihydro-4-oxo-9-(4H-1,2,4-triazol-4-yl)- [ACD/Index Name]
7-Chlor-4-oxo-9-(4H-1,2,4-triazol-4-yl)-4,5-dihydro[1,2,4]triazolo[1,5-a]chinoxalin-2-carbonsäure [German] [ACD/IUPAC Name]
7-Chloro-4-oxo-9-(4H-1,2,4-triazol-4-yl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylic acid [ACD/IUPAC Name]
Acide 7-chloro-4-oxo-9-(4H-1,2,4-triazol-4-yl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxylique [French] [ACD/IUPAC Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.980
Molar Refractivity: 78.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -1.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 109.6±7.0 dyne/cm
Molar Volume: 158.1±7.0 cm3

Click to predict properties on the Chemicalize site


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