ChemSpider 2D Image | 1-(2,6-Dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid | C10H7Cl2N3O2

1-(2,6-Dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid

  • Molecular FormulaC10H7Cl2N3O2
  • Average mass272.087 Da
  • Monoisotopic mass270.991547 Da
  • ChemSpider ID25996321

More details:

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

1-(2,6-Dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid [ACD/IUPAC Name]
1-(2,6-Dichlorphenyl)-5-methyl-1H-1,2,4-triazol-3-carbonsäure [German] [ACD/IUPAC Name]
1154101-06-0 [RN]
1H-1,2,4-Triazole-3-carboxylic acid, 1-(2,6-dichlorophenyl)-5-methyl- [ACD/Index Name]
Acide 1-(2,6-dichlorophényl)-5-méthyl-1H-1,2,4-triazole-3-carboxylique [French] [ACD/IUPAC Name]
MFCD12106486 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 512.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 263.6±32.9 °C
Index of Refraction: 1.685
Molar Refractivity: 64.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.52
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 169.1±7.0 cm3

Click to predict properties on the Chemicalize site


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