ChemicalBook--->CAS DataBase List--->301669-82-9

301669-82-9

301669-82-9 Structure

301669-82-9 Structure
IdentificationBack Directory
[Name]

4-Hydroxy Omeprazole
[CAS]

301669-82-9
[Synonyms]

Omeprazole Impurity 2
Omeprazole Impurity IV
Esomeprazol impurity M
Esomeprazol impurity N
Esomeprazole impurity N
4'-O-DesMethyloMeprazole
EsoMeprazole sodiuM iMpurity M
EsoMeprazole related substance H215/01
4-Hydroxy Omeprazole, Preparation Kit See A187355
2-[[(5-Methoxy-1H-benzimidazol-2-yl)sulfinyl]methyl]-3,5-dimethyl-4-pyridinol
2-[[(6-Methoxy-1H-benzimidazol-2-yl)sulfinyl]methyl]-3,5-dimethyl-4-pyridinol
4-Pyridinol, 2-[[(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]methyl]-3,5-dimethyl-
2-[[(5-Methoxy -1H-benziMidazol-2-yl)sulfinyl]Methyl]-3,5-diMethyl-1-4(1H)-pyridone
4-Hydroxy OMeprazole, Preparation Kit (Contains 4-Hydroxy OMeprazole Sulfide and M-Chloroperoxybenzoic Acid)
[Molecular Formula]

C16H17N3O3S
[MDL Number]

MFCD09840749
[MOL File]

301669-82-9.mol
[Molecular Weight]

331.39
Chemical PropertiesBack Directory
[Appearance]

Light-Yellow Solid
[Melting point ]

200-201°C
[Boiling point ]

726.5±70.0 °C(Predicted)
[density ]

1.46±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

soluble in DMF, DMSO, Ethanol, Methanol
[form ]

Solid
[pka]

8.39±0.28(Predicted)
[color ]

White to Light-Yellow
[InChI]

InChI=1S/C16H17N3O3S/c1-9-7-17-14(10(2)15(9)20)8-23(21)16-18-12-5-4-11(22-3)6-13(12)19-16/h4-7H,8H2,1-3H3,(H,17,20)(H,18,19)
[InChIKey]

VSOAYQZFYNZNKR-UHFFFAOYSA-N
[SMILES]

C1(CS(C2NC3=CC(OC)=CC=C3N=2)=O)=NC=C(C)C(O)=C1C
Hazard InformationBack Directory
[Chemical Properties]

Light-Yellow Solid
[Uses]

A metabolite of Omeprazole, an anttiulcerative. This compound is not stable and can only be generated for short periods of time in solution. We have been unable to quantify the exact amount of 4-hydroxyomeprazole generated or measure its half-life.
[Uses]

A metaboloite of Omeprazole, an anttiulcerative
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