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Flunixin

CAT: 0013-GTR19202015-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202015-03Size:10 mg
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Description
Flunixin
CAS Number
38677-85-9
Field of Research
Immunology & Inflammation, Neuroscience
Smiles
O=C (O) C1=CC=CN=C1NC2=CC=CC (=C2C) C (F) (F) F
Molecular Formula
C14H11F3N2O2
Molecular Weight
296.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Flunixin

Flunixin is a pyridinemonocarboxylic acid that is nicotinic acid substituted at position 2 by a 2-methyl-3-(trifluoromethyl)phenylamino group. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic properties; used in veterinary medicine (usually as the meglumine salt) for treatment of horses, cattle and pigs. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic and an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor. It is a pyridinemonocarboxylic acid, an organofluorine compound and an aminopyridine. It is functionally related to a nicotinic acid. It is a conjugate acid of a flunixin(1-).

CAS Number38677-85-9
PubChem CID38081
IUPAC Name2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid
Molecular FormulaC14H11F3N2O2
Molecular Weight296.24
XLogP4.1
Topological Polar Surface Area62.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity376
SMILES
CC1=C(C=CC=C1NC2=C(C=CC=N2)C(=O)O)C(F)(F)F
InChI
InChI=1S/C14H11F3N2O2/c1-8-10(14(15,16)17)5-2-6-11(8)19-12-9(13(20)21)4-3-7-18-12/h2-7H,1H3,(H,18,19)(H,20,21)
InChIKey
NOOCSNJCXJYGPE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flunixin
CAS: 38677-85-9
CID: 38081
Formula: C14H11F3N2O2
MW: 296.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight296.24
XLogP34.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass296.07726208
Monoisotopic Mass296.07726208
Topological Polar Surface Area62.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity376
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes