Dapagliflozin (2S)-1,2-Propanediol Monohydrate
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- structure.search.product.name Dapagliflozin (2S)-1,2-Propanediol Monohydrate
- Product Code: MM3611.00
- CAS Number: 960404-48-2
- Brand: Mikromol
Product Overview
Product Code
MM3611.00
CAS Number
Product Format
Neat
Molecular Formula
C21H25ClO6.C3H8O2.H2O
Molecular Weight
502.98
Product Categories
Mikromol, API Reference Standards & Research Materials, Additional pharmaceutical toxicology reference materials
Product Type
APIAlternate CAS Number
Drug Type
Blood Glucose Regulators
Documentation
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Product Information
Analyte Data
Analyte Name
Dapagliflozin (2S)-1,2-Propanediol Monohydrate
CAS Number
960404-48-2
Molecular Formula
C21H25ClO6.C3H8O2.H2O
Molecular Weight
502.98
Accurate Mass
502.197
SMILES
O.CCOc1ccc(Cc2cc(ccc2Cl)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc1.C[C@H](O)CO
InChI
InChI=1S/C21H25ClO6.C3H8O2.H2O/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21;1-3(5)2-4;/h3-8,10,17-21,23-26H,2,9,11H2,1H3;3-5H,2H2,1H3;1H2/t17-,18-,19+,20-,21+;3-;/m10./s1
IUPAC
(2S,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;(2S)-propane-1,2-diol;hydrate
Alternate CAS Number
Free base: 461432-26-8
Product Data
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Tariff Code
29329900
Product Format
Neat