Ketoprofen EP Impurity E

CAT: 1596-AR-K01056-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-K01056-02Size:25 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

59512-16-2

Synonyms

2- (3-benzoylphenyl) propanamide;3-Benzoyl-alpha-methylbenzeneacetamide

Molecular Formula

C16H15NO2

Molecular Weight

253.30

API Name

Ketoprofen

Chemical Information

Ketoprofen amide

CAS Number	59512-16-2
PubChem CID	3042314
IUPAC Name	2-(3-benzoylphenyl)propanamide
Molecular Formula	C16H15NO2
Molecular Weight	253.29
XLogP	2.5
Topological Polar Surface Area	60.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	19
Formal Charge	0
Complexity	334

SMILES

CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C16H15NO2/c1-11(16(17)19)13-8-5-9-14(10-13)15(18)12-6-3-2-4-7-12/h2-11H,1H3,(H2,17,19)

InChIKey

KLWMCJJRUWWDSW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 59512-16-2

CID: 3042314

Formula: C16H15NO2

MW: 253.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	253.29
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	253.110278721
Monoisotopic Mass	253.110278721
Topological Polar Surface Area	60.2 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	334
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes