Found 894 results

Search term: MF = 'C_{11}H_{9}F_{2}N_{3}O_{2}'
ChemSpider 2D Image | 1-(3,5-Difluorophenyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid | C11H9F2N3O2

1-(3,5-Difluorophenyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC11H9F2N3O2
  • Average mass253.205 Da
  • Monoisotopic mass253.066284 Da
  • ChemSpider ID24804101

More details:

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

1-(3,5-Difluorophenyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1-(3,5-Difluorphenyl)-5-ethyl-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-(3,5-difluorophenyl)-5-ethyl- [ACD/Index Name]
Acide 1-(3,5-difluorophényl)-5-éthyl-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]
1-(3,5-Difluoro-phenyl)-5-ethyl-1H-[1,2,3]triazole-4-carboxylic acid
1096911-70-4 [RN]
MFCD11540092 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 421.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 208.9±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 59.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.47
ACD/LogD (pH 7.4): -0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 172.4±7.0 cm3

Click to predict properties on the Chemicalize site


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