ChemicalBook--->CAS DataBase List--->1091621-61-2

1091621-61-2

1091621-61-2 Structure

1091621-61-2 Structure
IdentificationBack Directory
[Name]

Loxoprofen Ring-opening IMpurity
[CAS]

1091621-61-2
[Synonyms]

Loxoprofen Impurity K
Loxoprofen Impurity 12
Loxoprofen Ring-opening IMpurity
Loxoprofen sodium degrades impurity B
4-(1-Carboxyethyl)-δ-oxo-benzenehexanoic Acid
Benzenehexanoic acid, 4-(1-carboxyethyl)-δ-oxo-
Bendamustine Impurity: 6-[4-(1-Carboxy-ethyl)-phenyl]-5-oxo-hexanoic acid
[Molecular Formula]

C15H18O5
[MDL Number]

MFCD30718687
[MOL File]

1091621-61-2.mol
[Molecular Weight]

278.3
Chemical PropertiesBack Directory
[Boiling point ]

504.8±35.0 °C(Predicted)
[density ]

1.238±0.06 g/cm3(Predicted)
[pka]

4.32±0.10(Predicted)
[InChI]

InChI=1S/C15H18O5/c1-10(15(19)20)12-7-5-11(6-8-12)9-13(16)3-2-4-14(17)18/h5-8,10H,2-4,9H2,1H3,(H,17,18)(H,19,20)
[InChIKey]

ALZUIVGLLMTAMW-UHFFFAOYSA-N
[SMILES]

C(C1C=CC(=CC=1)CC(=O)CCCC(=O)O)(C)C(=O)O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

4-(1-Carboxyethyl)-δ-oxo-benzenehexanoic Acid is a degradation product of Loxoprofen (L472900, Na salt), a non-selective nonsteroidal anti-inflammatory drug (NSAID) that has been effective in reducing atherosclerosis in mice by reducing inflammation. It becomes active after metabolism in the body and inhibits the activation of cyclooxygenase.
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