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(1s,2r,4s,5s,7r)-7-[2-Hydroxy(Di-2-Thienyl)Acetoxy]-9,9-Dimethyl-3-Oxa-9-Azoniatricyclo[3.3.1.0<Sup>2,4</Sup>]Nonane Bromide

(1S,2R,4S,5S,7R)-7-[2-Hydroxy(Di-2-Thienyl)Acetoxy]-9,9-Dimethyl-3-Oxa-9-Azoniatricyclo[3.3.1.0<Sup>2,4</Sup>]Nonane Bromide / CAS : 186691-13-4

Appearance solid UN -
HS 29349990 DG Class -
Synonyms Tiotropium; Spiriva; Tiotropium Cation; Ba 679 Br
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Properties

Summary

Formula
C19H22BrNO4S2
Molecular Mass
472.41600
Exact Mass
471.01700
PSA
115.54000
Logp
-0.69150
IUPAC
[(1S,2S,4R,5R)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2,2-dithiophen-2-ylacetate
SMILES
C[N+]1([C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)C(C4=CC=CS4)(C5=CC=CS5)O)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Appearance
solid
Acidity and Basicity
neutral

Export information

HS Code
29349990
Export Rebate
10%

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