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Dapagliflozin Propanediol

Dapagliflozin Propanediol / CAS : 960404-48-2

Appearance White to Off-White Solid UN -
HS - DG Class -
Synonyms Dapagliflozin Propanediol Monohydrate; Dapagliflozin Propanediol Hydrate; Farxiga; Dapagliflozin ((2S)-1,2-Propanediol, Hydrate); Dapagliflozin S-Propylene Glycol Monohydrate; Dapagliflozin Propylene Glycolate Hydrate; (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; Dapagliflozin; Dapagliflozin Propylene Glycol Hydrate; (2S,3R,4R,5S,6R)-2-(4-Chloro-3-(4-Ethoxybenzyl)Phenyl)-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-3,4,5-Triol Compound WITH (S)-Propane-1,2-DIOL (1:1) Hydrate; Dapagliflozin (S)-Propylene Glycol Hydrate; Dapagliflozin Propylene Glycol; Dapagliflozin (2S)-1,2-Propanediol Hydrate; BMS-512148 (2S)-1,2-Propanediol, Hydrate; Dapagliflozin (2S)-1,2-Propanediol Monohydrate; Xigduo Component Dapagliflozin Propanediol; Dapagliflozin Propanediol Component OF Xigduo; Dapagliflozin Compound WITH (2S)-1,2-Propanediol Hydrate; (2S)-Propane-1,2-diol (2S,3R,4R,5S,6R)-2-{4-Chloro-3-[(4-Ethoxyphenyl)Methyl]Phenyl}-6-(Hydroxymethyl)Oxane-3,4,5-Triol Hydrate; (2S)-Propane-1,2-diol--(1S)-1,5-Anhydro-1-[4-Chloro-3-(4-Ethoxybenzyl)Phenyl]-D-Glucitol--Water (1/1/1); (2S,3R,4R,5S,6R)-2-(4-Chloro-3-(4-Ethoxybenzyl)Phenyl)-6-(Hydroxymethyl)Tetrahydro- 2H-Pyran-3,4,5-Triol, (2S)-Propane-1,2-DIOL (1:1) Monohydrate; (2S,3R,4R,5S,6R)-2-(4-Chloro-3-(4-Ethoxybenzyl)Phenyl)-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-3,4,5-Triol (S)-Propane-1,2-diol Hydrate; (2S,3R,4R,5S,6R)-2-(4-Chloro-3-(4-Ethoxybenzyl)Phenyl)-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-3,4,5-Triol, (2S)-Propane-1,2-diol (1:1) Monohydrate
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Properties

Summary

Formula
C24H35ClO9
Molecular Mass
502.98200
Exact Mass
502.19700
PSA
149.07000
Logp
1.13960
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
SMILES
CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl.C[C@@H](CO)O.O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Inhibitors

Chemical and Physical Properties

Melting Point
74 - 78°C
Appearance
White to Off-White Solid

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