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65813-55-0

1-Oxo Ibuprofen

CAS: 65813-55-0

Molecular Formula: C13H16O3

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65813-55-0 - Names and Identifiers

Name 1-Oxo Ibuprofen
Synonyms AKOS 90964
1-Oxo Ibuprofen
IBUPROFEN IMPURITY J
2-(4-Isobutyrylphenyl)propionic Acid
1-Oxo Ibuprofen (Ibuprofen Impurity J)
(2RS)-2-(4-ISOBUTYRYLPHENYL)PROPANOIC ACID
a-Methyl-4-(2-methyl-1-oxopropyl)benzeneacetic Acid
(2RS)-2-[4-(2-Methylpropanoyl)phenyl] propanoic acid
CAS 65813-55-0

65813-55-0 - Physico-chemical Properties

Molecular FormulaC13H16O3
Molar Mass220.26
Density1.106±0.06 g/cm3(Predicted)
Melting Point85-87°C
Boling Point378.0±17.0 °C(Predicted)
Solubility Chloroform (Slightly), Methanol (Slightly)
AppearanceSolid
ColorWhite to Off-White
BRN2844898
pKa4.08±0.10(Predicted)
Storage Condition-20°C Freezer

65813-55-0 - Risk and Safety

Hazard SymbolsXn - Harmful
Harmful
Risk Codes22 - Harmful if swallowed
WGK Germany3
HS Code2917394000

65813-55-0 - Reference Information

, is a potential impurity in the preparation of Ibuprofen. Ibuprofen is an anti-inflammatory inhibitor of COX-1 and COX-2 with an IC50 of 13 μm and 370 μm, respectively.
biological activity
Last Update:2024-04-10 22:29:15
65813-55-0
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View History
65813-55-0
22510-08-3
92638-84-1
148607-24-3
87450-10-0
1188-02-9
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