ChemSpider 2D Image | Methyl 1-(3,4-dichlorophenyl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxylate | C10H7Cl2N3O3

Methyl 1-(3,4-dichlorophenyl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxylate

  • Molecular FormulaC10H7Cl2N3O3
  • Average mass288.087 Da
  • Monoisotopic mass286.986450 Da
  • ChemSpider ID21391356

More details:






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

1-(3,4-Dichlorophényl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
1000576-81-7 [RN]
1H-1,2,4-Triazole-3-carboxylic acid, 1-(3,4-dichlorophenyl)-2,5-dihydro-5-oxo-, methyl ester [ACD/Index Name]
1H-1,2,4-Triazole-3-carboxylic acid, 1-(3,4-dichlorophenyl)-4,5-dihydro-5-oxo-, methyl ester
Methyl 1-(3,4-dichlorophenyl)-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxylate [ACD/IUPAC Name]
Methyl 1-(3,4-dichlorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate
Methyl-1-(3,4-dichlorphenyl)-5-oxo-2,5-dihydro-1H-1,2,4-triazol-3-carboxylat [German] [ACD/IUPAC Name]
1H-1,2,4-triazole-3-carboxylate
95%
Methyl 1-(3,4-dichlorophenyl)-2,5-dihydro-5-oxo-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 398.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.9±3.0 kJ/mol
Flash Point: 194.9±30.7 °C
Index of Refraction: 1.671
Molar Refractivity: 65.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.77
ACD/KOC (pH 5.5): 203.30
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.77
ACD/KOC (pH 7.4): 203.31
Polar Surface Area: 71 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 175.7±7.0 cm3

Click to predict properties on the Chemicalize site






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