ChemSpider 2D Image | 3-(1,3-Benzodioxol-5-yl)-3'-(2,4-dimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole | C19H14N4O6

3-(1,3-Benzodioxol-5-yl)-3'-(2,4-dimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole

  • Molecular FormulaC19H14N4O6
  • Average mass394.338 Da
  • Monoisotopic mass394.091339 Da
  • ChemSpider ID34968066

More details:

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

3-(1,3-Benzodioxol-5-yl)-3'-(2,4-dimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-yl)-3'-(2,4-dimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-yl)-3'-(2,4-diméthoxyphényl)-5,5'-bi-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
5,5'-Bi-1,2,4-oxadiazole, 3-(1,3-benzodioxol-5-yl)-3'-(2,4-dimethoxyphenyl)- [ACD/Index Name]
1775344-73-4 [RN]
MFCD28053020

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

Density: 1.4±0.1 g/cm3
Boiling Point: 603.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 319.0±34.3 °C
Index of Refraction: 1.598
Molar Refractivity: 96.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 120.01
ACD/KOC (pH 5.5): 1071.30
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.01
ACD/KOC (pH 7.4): 1071.30
Polar Surface Area: 115 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 283.0±3.0 cm3

Click to predict properties on the Chemicalize site


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