Found 6076 results

Search term: MF = 'C_{11}H_{11}N_{3}O_{2}'

ChemSpider 2D Image | 5-Ethyl-1-phenyl-1H-1,2,3-triazole-4-carboxylic acid | C11H11N3O2

5-Ethyl-1-phenyl-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC11H11N3O2
  • Average mass217.224 Da
  • Monoisotopic mass217.085129 Da
  • ChemSpider ID21919776

More details:






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

1H-1,2,3-Triazole-4-carboxylic acid, 5-ethyl-1-phenyl- [ACD/Index Name]
5-Ethyl-1-phenyl-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
5-Ethyl-1-phenyl-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 5-éthyl-1-phényl-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]
[716361-89-6]
1H-1,2,3-Triazole-4-carboxylic acid, 5-ethyl-1-phenyl- (9CI)
1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID,5-ETHYL-1-PHENYL-
1H-1,2,3-TRIAZOLE-4-CARBOXYLICACID, 5-ETHYL-1-PHENYL-
1H-1,2,3-Triazole-4-carboxylicacid,5-ethyl-1-phenyl-(9CI)
5-ethyl-1-phenyl-1,2,3-triazole-4-carboxylic acid
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 421.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 209.0±26.5 °C
Index of Refraction: 1.636
Molar Refractivity: 59.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.92
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 51.8±7.0 dyne/cm
Molar Volume: 166.6±7.0 cm3

Click to predict properties on the Chemicalize site






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