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Amfenac Sodium Salt

CAT: 0024-sc-210793Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-210793Size:100 mg
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CAS Number
61618-27-7

Chemical Information

Amfenac Sodium

Amfenac sodium hydrate is a hydrate that is the monohydrate of the sodium salt of amfenac. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic, a cyclooxygenase 2 inhibitor and a cyclooxygenase 1 inhibitor. It contains a sodium (2-amino-3-benzoylphenyl)acetate.

CAS Number61618-27-7
PubChem CID23663941
IUPAC Namesodium;2-(2-amino-3-benzoylphenyl)acetate;hydrate
Molecular FormulaC15H14NNaO4
Molecular Weight295.26
Topological Polar Surface Area84.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity342
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=CC(=C2N)CC(=O)[O-].O.[Na+]
InChI
InChI=1S/C15H13NO3.Na.H2O/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10;;/h1-8H,9,16H2,(H,17,18);;1H2/q;+1;/p-1
InChIKey
QZNJPJDUBTYMRS-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Amfenac Sodium
CAS: 61618-27-7
CID: 23663941
Formula: C15H14NNaO4
MW: 295.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass295.08205221
Monoisotopic Mass295.08205221
Topological Polar Surface Area84.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity342
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-A06134-01Amfenac Sodium Salt
FA17348-01Amfenac sodium salt hydrate
T20197-01Amfenac sodium
HY-17479B-01Amfenac (sodium)
HY-17479A-01Amfenac (Sodium Hydrate)
MBS3841639-01Amfenac Sodium Monohydrate
TRC-A576500-50MGAmfenac Sodium Hydrate
HY-17479BS-01Amfenac-d5 (sodium)
592803Amfenac sodium H2O

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