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Ketoprofen

CAT: 1299-RM-K201600-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-K201600-02Size:25 mg
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CAS Number
22071-15-4
Synonyms
(2RS) -2- (3-Benzoylphenyl) propanoic acid
Molecular Formula
C16H14O3
Molecular Weight
254.28
Target Alternative Name
Ketoprofen
Product Name Synonym
(2RS) -2- (3-Benzoylphenyl) propanoic acid

Chemical Information

Ketoprofen

Ketoprofen is an oxo monocarboxylic acid that consists of propionic acid substituted by a 3-benzoylphenyl group at position 2. It has a role as a non-steroidal anti-inflammatory drug, an antipyretic, an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor, a xenobiotic, an environmental contaminant and a drug allergen. It is a member of benzophenones and an oxo monocarboxylic acid. It is functionally related to a propionic acid.

CAS Number22071-15-4
PubChem CID3825
IUPAC Name2-(3-benzoylphenyl)propanoic acid
Molecular FormulaC16H14O3
Molecular Weight254.28
XLogP3.1
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity331
SMILES
CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)O
InChI
InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)
InChIKey
DKYWVDODHFEZIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ketoprofen
CAS: 22071-15-4
CID: 3825
Formula: C16H14O3
MW: 254.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight254.28
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass254.094294304
Monoisotopic Mass254.094294304
Topological Polar Surface Area54.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity331
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-B0227-01Ketoprofen

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