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Validamine Structure

Validamine

Chemical Properties

Boiling point 345.6±42.0 °C(Predicted)
Density  1.434±0.06 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
pka 13.92±0.70(Predicted)
InChI InChI=1S/C7H15NO4/c8-4-1-3(2-9)5(10)7(12)6(4)11/h3-7,9-12H,1-2,8H2/t3-,4+,5-,6+,7+/m1/s1
InChIKey GSQYAWMREAXBHF-UOYQFSTFSA-N
SMILES [C@H]1(N)C[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
CAS DataBase Reference 32780-32-8(CAS DataBase Reference)
FDA UNII PV2WI7495P

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P305+P351+P338
HS Code  29094990

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