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Escitalopram oxalate Structure

Escitalopram oxalate

Chemical Properties

Melting point 152-153°C
alpha  D +12.31° (c = 1 in methanol)
storage temp.  2-8°C
solubility  DMSO: ≥15mg/mL
form  powder
color  white to tan
Merck  14,2318
BCS Class 1
Stability Hygroscopic
InChI InChI=1S/C20H21FN2O.C2H2O4/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20;3-1(4)2(5)6/h4-9,12H,3,10-11,14H2,1-2H3;(H,3,4)(H,5,6)
InChIKey KTGRHKOEFSJQNS-UHFFFAOYSA-N
SMILES C1(CCCN(C)C)(C2=CC=C(F)C=C2)C2=C(C=C(C#N)C=C2)CO1.C(O)(=O)C(O)=O
CAS DataBase Reference 219861-08-2(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
RTECS  NP6333500
HS Code  29322090

Usage And Synthesis

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