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3-(1H-Tetrazol-5-yl)benzaldehyde Structure

3-(1H-Tetrazol-5-yl)benzaldehyde

Chemical Properties

Melting point 196-198 °C
Boiling point 416.0±47.0 °C(Predicted)
Density  1.400±0.06 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
pka 3.99±0.10(Predicted)
InChI 1S/C8H6N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-5H,(H,9,10,11,12)
InChIKey GWZICMAGCVWLAY-UHFFFAOYSA-N
SMILES [nH]1nnc(n1)c2cc(ccc2)C=O

Safety Information

WGK Germany  WGK 3
HazardClass  IRRITANT
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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