ChemSpider 2D Image | Methyl 5-amino-1-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylate | C11H12N4O3

Methyl 5-amino-1-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylate

  • Molecular FormulaC11H12N4O3
  • Average mass248.238 Da
  • Monoisotopic mass248.090942 Da
  • ChemSpider ID25929350

More details:

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

1H-1,2,3-Triazole-4-carboxylic acid, 5-amino-1-(2-methoxyphenyl)-, methyl ester [ACD/Index Name]
5-Amino-1-(2-méthoxyphényl)-1H-1,2,3-triazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-amino-1-(2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylate [ACD/IUPAC Name]
Methyl-5-amino-1-(2-methoxyphenyl)-1H-1,2,3-triazol-4-carboxylat [German] [ACD/IUPAC Name]
[1221715-75-8] [RN]
1221715-75-8 [RN]
5-Amino-1-(2-methoxy-phenyl)-1H-[1,2,3]triazole-4-carboxylic acid methyl ester
BS-4601
methyl 5-amino-1-(2-methoxyphenyl)-1,2,3-triazole-4-carboxylate
MFCD19268279 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 454.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.4±3.0 kJ/mol
Flash Point: 228.7±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 63.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.40
ACD/KOC (pH 5.5): 145.85
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.40
ACD/KOC (pH 7.4): 145.85
Polar Surface Area: 92 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 178.2±7.0 cm3

Click to predict properties on the Chemicalize site


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