ChemSpider 2D Image | 3-(5-Ethyl-1,2,4-oxadiazol-3-yl)benzoic acid | C11H10N2O3

3-(5-Ethyl-1,2,4-oxadiazol-3-yl)benzoic acid

  • Molecular FormulaC11H10N2O3
  • Average mass218.209 Da
  • Monoisotopic mass218.069138 Da
  • ChemSpider ID21242694

More details:

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

3-(5-Ethyl-1,2,4-oxadiazol-3-yl)benzoesäure [German] [ACD/IUPAC Name]
3-(5-Ethyl-1,2,4-oxadiazol-3-yl)benzoic acid [ACD/IUPAC Name]
859155-81-0 [RN]
Acide 3-(5-éthyl-1,2,4-oxadiazol-3-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-(5-ethyl-1,2,4-oxadiazol-3-yl)- [ACD/Index Name]
[859155-81-0] [RN]
3-(5-Ethyl-[1,2,4]Oxadiazol-3-Yl)-Benzoic Acid
3-(5-Ethyl-1,2,4-oxadiazol-3-yl)benzoicacid
CS-11108
Ethyl 3-(benzylamino)but-2-enoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD08061016 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 431.8±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 214.9±29.3 °C
Index of Refraction: 1.573
Molar Refractivity: 55.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.40
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 169.3±3.0 cm3

Click to predict properties on the Chemicalize site


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