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N-Desmethyl zolmitriptan HCl Structure

N-Desmethyl zolmitriptan HCl

Chemical Properties

Melting point 63-66°C
Boiling point 577.7±35.0 °C(Predicted)
Density  1.235±0.06 g/cm3(Predicted)
storage temp.  -20°C Freezer
solubility  DMSO (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
pka 12.57±0.40(Predicted)
form  Solid
color  Light Yellow to Light Brown
Stability Hygroscopic
Major Application pharmaceutical (small molecule)
InChI 1S/C15H19N3O2/c1-16-5-4-11-8-17-14-3-2-10(7-13(11)14)6-12-9-20-15(19)18-12/h2-3,7-8,12,16-17H,4-6,9H2,1H3,(H,18,19)/t12-/m0/s1
InChIKey QGGCHSMZXKNGCK-LBPRGKRZSA-N
SMILES N1[C@H](COC1=O)Cc2cc3c([nH]cc3CCNC)cc2
CAS DataBase Reference 139264-35-0

Safety Information

HS Code  2934990002
Storage Class 11 - Combustible Solids

Usage And Synthesis

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