Flurbiprofen EP Impurity E

CAT: 1299-RM-F210605-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-F210605-02Size:25 mg

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CAS Number

137045-30-8

Synonyms

2-Fluoro-[1,1'-biphenyl]-4-carboxylic Acid

Molecular Formula

C13H9FO2

Molecular Weight

216.21

Target Alternative Name

Flurbiprofen

Product Name Synonym

2-Fluoro-[1,1'-biphenyl]-4-carboxylic Acid

Chemical Information

2-Fluorobiphenyl-4-carboxylic acid

CAS Number	137045-30-8
PubChem CID	16217493
IUPAC Name	3-fluoro-4-phenylbenzoic acid
Molecular Formula	C13H9FO2
Molecular Weight	216.21
XLogP	3.2
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	248

SMILES

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

InChI

InChI=1S/C13H9FO2/c14-12-8-10(13(15)16)6-7-11(12)9-4-2-1-3-5-9/h1-8H,(H,15,16)

InChIKey

PFKITESTTSWHMP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 137045-30-8

CID: 16217493

Formula: C13H9FO2

MW: 216.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	216.21
XLogP3	3.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	216.05865769
Monoisotopic Mass	216.05865769
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	248
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-F210601-01	Flurbiprofen EP Impurity A
RM-F210603-01	Flurbiprofen EP Impurity C
RM-F210604-01	Flurbiprofen EP Impurity D
RM-F210602-01	Flurbiprofen EP Impurity B
RM-F210664-01	S, S-Flurbiprofen EP Impurity B
RM-L202405-01	Levothyroxine EP Impurity E; Liothyronine EP Impurity E
RM-O132305-01	Omeprazole EP Impurity E; Esomeprazole EP Impurity E
RM-P182605-01	Prazosin EP Impurity E; Doxazosin EP Impurity H; Terazosin EP Impurity E
RM-F210614-01	Flurbiprofen Impurity ⅳ
RM-F210616-01	Flurbiprofen Impurity ⅵ