Chemical Compound

Pregabalin Impurity 74

CAS Registry Number 29091-09-6
Pregabalin Impurity 74 chemical structure
Primary Record

Pregabalin Impurity 74

In stock
1,957 g
Purity
98.4 %
CAS
29091-09-6

Compound Identifiers & Properties

CAS
29091-09-6
PubChem CID
169438188
SMILES
CC(C)C[C@H]1CC(=O)N(C1)CC2([C@H]([C@@H]([C@@H](CO2)O)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)O.CC(C)C[C@H]1CC(=O)N(C1)CC2([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)O
Canonical SMILES
CC(C)C[C@H]1CC(=O)N(CC2(O)OC[C@@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H]2O)C1.CC(C)C[C@H]1CC(=O)N(CC2(O)O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H]2O)C1

Names & Synonyms

  • Pregabalin Impurity 74
  • Pregabalin Impurity 114
  • 2,4-Dichloro-3,5-dinitrobenzotrifluoride
  • PD 312236, PD 312237 Mixture
  • (S)-1-(((3S,4S,5R)-2,3-dihydroxy-5-(hydroxymethyl)-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydrofuran-2-yl)methyl)-4-isobutylpyrrolidin-2-one--(S)-4-isobutyl-1-(((3S,4R,5R)-2,3,5-trihydroxy-4-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methyl)pyrrolidin-2-one (1/1)
  • 1-Deoxy-4-O-ss-D-galactopyranosyl-1-[(4S)-4-(2-methylpropyl)-2-oxo-1-pyrrolidinyl]-ss-D-fructose, Pyranose / Furanose Mixture; Pregabalin impurity
  • 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene 2,4-Dichloro-1-(trifluoromethyl)-3,5-dinitrobenzene 2,4-Dichloro-3,5-dinitrobenzotrifluoride
  • 29091-09-6