Tiotropium-d3 Bromide
Product Code
TRC-T444852
CAS Number
Product Format
Neat
Molecular Formula
C19 D3 H19 N O4 S2 . Br
Molecular Weight
475.435
Product Categories
TRC, Enzyme inhibitors, Enzyme agonists & antagonists, API Reference Standards & Research Materials, Acetylcholine Receptors, Neurotransmission, Memory, Learning and Cognition, Parkinson's, Schizophrenia, Pain and Inflammation, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials
Alternate CAS Number
Unlabelled CAS Number
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- Product Name: Tiotropium-d3 Bromide
- Product Code: TRC-T444852
- CAS Number: 1127226-56-5
- Brand: TRC
Documentation
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Product Information
Chemical Data
Analyte Name
Tiotropium N-methyl-d3 bromide
CAS Number
1127226-56-5
Molecular Formula
C19 D3 H19 N O4 S2 . Br
Molecular Weight
475.435
Accurate Mass
474.036
SMILES
[Br-].[2H]C([2H])([2H])[N+]1(C)[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)C(O)(c4cccs4)c5cccs5
InChI
InChI=1S/C19H22NO4S2.BrH/c1-20(2)12-9-11(10-13(20)17-16(12)24-17)23-18(21)19(22,14-5-3-7-25-14)15-6-4-8-26-15;/h3-8,11-13,16-17,22H,9-10H2,1-2H3;1H/q+1;/p-1/t11-,12-,13+,16-,17+;/i1D3;/t11-,12-,13+,16-,17+,20?;
IUPAC
[(1R,2R,4S,5S)-9-methyl-9-(trideuteriomethyl)-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-hydroxy-2,2-bis(2-thienyl)acetate bromide
Alternate CAS Number
1352567-52-2
Unlabelled CAS Number
136310-93-5
SIL Type
Deuterium
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
API
Product Format
Neat
API Family
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