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Tiotropium Bromide

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Tiotropium Bromide / CAS : 136310-93-5

Appearance White to off white crystalline powder UN 0.0
HS 29398000 DG Class 0.0
Synonyms Spiriva Handihaler; Spiriva Respimat; Spiriva; (1R,2R,4S,5S,7s)-7-(2-Hydroxy-2,2-di(Thiophen-2-yl)Acetoxy)-9,9-Dimethyl-3-oxa-9-Azatricyclo[3.3.1.02,4]Nonan-9-ium Bromide
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Properties

Summary

Formula
C19H22BrNO4S2
Molecular Mass
472.41600
Exact Mass
471.01700
PSA
115.54000
Logp
-0.69150
IUPAC
[(1R,2R,4S,5S)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2,2-dithiophen-2-ylacetate;bromide
SMILES
C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O)C.[Br-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Respiratory Drugs

Chemical and Physical Properties

Melting Point
218-2200C
Appearance
White to off white crystalline powder

Export information

HS Code
29398000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36
Safety Label
Xi

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