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Tiotropium Bromide Monohydrate

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Tiotropium Bromide Monohydrate / CAS : 139404-48-1

Appearance White to off white crystalline powder UN 0.0
HS 29349990 DG Class 0.0
Synonyms Tiotropium Bromide Hydrate; [(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;Hydrate;
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Properties

Summary

Formula
C19H24BrNO5S2
Molecular Mass
490.43200
Exact Mass
489.02800
PSA
124.77000
Logp
-0.75580
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;hydrate
SMILES
C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O)C.O.[Br-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Respiratory Drugs

Chemical and Physical Properties

Melting Point
218-220ºC
Appearance
White to off white crystalline powder

Export information

HS Code
29349990
Export Rebate
10%
UN No.
0.0
DG-Class
0.0

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