ChemSpider 2D Image | 3-[2-(Benzyloxy)phenyl]-5-(chloromethyl)-1,2,4-oxadiazole | C16H13ClN2O2

3-[2-(Benzyloxy)phenyl]-5-(chloromethyl)-1,2,4-oxadiazole

  • Molecular FormulaC16H13ClN2O2
  • Average mass300.740 Da
  • Monoisotopic mass300.066559 Da
  • ChemSpider ID21373507

More details:






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

1,2,4-Oxadiazole, 5-(chloromethyl)-3-[2-(phenylmethoxy)phenyl]- [ACD/Index Name]
3-[2-(Benzyloxy)phenyl]-5-(chlormethyl)-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
3-[2-(Benzyloxy)phenyl]-5-(chloromethyl)-1,2,4-oxadiazole [ACD/IUPAC Name]
3-[2-(Benzyloxy)phényl]-5-(chlorométhyl)-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
[1,2,4]oxadiazole
[936497-78-8]
3-(2-(Benzyloxy)phenyl)-5-(chloromethyl)-1,2,4-oxadiazole
3-(2-Benzyloxyphenyl)-5-(chloromethyl)-1,2,4-oxadiazole
3-(2-Benzyloxy-phenyl)-5-chloromethyl-
3-(2-Benzyloxyphenyl)-5-chloromethyl[1,2,4]oxadiazole
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 468.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 237.0±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 80.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1373.54
ACD/KOC (pH 5.5): 6132.90
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1373.54
ACD/KOC (pH 7.4): 6132.90
Polar Surface Area: 48 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 236.4±3.0 cm3

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