83881-37-2

Name Cetirizine Amide
CAS 83881-37-2
Molecular Formula C21H26ClN3O2
MDL Number MFCD01751128
Molecular Weight 387.91
MOL File 83881-37-2.mol
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Chemical Properties

Appearance Off-White Solid
Melting point  107-109°C
Boiling point  539.3±50.0 °C(Predicted)
density  1.210±0.06 g/cm3(Predicted)
storage temp.  Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 15.56±0.40(Predicted)
color  White to Pale Brown
Major Application pharmaceutical (small molecule)
InChI 1S/C21H26ClN3O2/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)25-12-10-24(11-13-25)14-15-27-16-20(23)26/h1-9,21H,10-16H2,(H2,23,26)
InChIKey LVJDQBJDVOYDLA-UHFFFAOYSA-N
SMILES Clc1ccc(cc1)C(N3CCN(CC3)CCOCC(=O)N)c2ccccc2

Safety Data

WGK Germany  WGK 3
HS Code  2933599550
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

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