ChemSpider 2D Image | 1-(2,2-Diethoxyethyl)-1H-1,2,3-triazole-4-carboxylic acid | C9H15N3O4

1-(2,2-Diethoxyethyl)-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC9H15N3O4
  • Average mass229.233 Da
  • Monoisotopic mass229.106262 Da
  • ChemSpider ID25997279

More details:

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

1-(2,2-Diethoxyethyl)-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(2,2-Diethoxyethyl)-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1235440-33-1 [RN]
1H-1,2,3-Triazole-4-carboxylic acid, 1-(2,2-diethoxyethyl)- [ACD/Index Name]
Acide 1-(2,2-diéthoxyéthyl)-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]
MFCD15209667 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 397.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 194.0±30.7 °C
Index of Refraction: 1.549
Molar Refractivity: 55.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.84
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 86 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 175.1±7.0 cm3

Click to predict properties on the Chemicalize site


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