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Fluoxetine oxalate

CAT: 0013-GTR19209291-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209291-01Size:25 mg
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Description
Fluoxetine oxalate is a selective serotonin reuptake inhibitor (SSRI) used in research on depression, OCD, and anxiety disorders. It is widely applied in both in vitro binding assays and in vivo behavioral studies to investigate serotonergic neurotransmission and pharmacological mechanisms.
CAS Number
114414-02-7
Field of Research
Cell Biology, Neuroscience, Pharmacology & Drug Discovery
Smiles
C (C (O) =O) (O) =O.C (OC1=CC=C (C (F) (F) F) C=C1) (CCNC) C2=CC=CC=C2
Molecular Formula
C19H20F3NO5
Molecular Weight
399.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fluoxetine oxalate
CAS Number114414-02-7
PubChem CID13013909
IUPAC NameN-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine;oxalic acid
Molecular FormulaC19H20F3NO5
Molecular Weight399.4
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity379
SMILES
CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F.C(=O)(C(=O)O)O
InChI
InChI=1S/C17H18F3NO.C2H2O4/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20;3-1(4)2(5)6/h2-10,16,21H,11-12H2,1H3;(H,3,4)(H,5,6)
InChIKey
CKOSCBUBUNGPOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fluoxetine oxalate
CAS: 114414-02-7
CID: 13013909
Formula: C19H20F3NO5
MW: 399.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass399.12935722
Monoisotopic Mass399.12935722
Topological Polar Surface Area95.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity379
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5813927Fluoxetine oxalate
HY-B0102DFluoxetine (oxalate)
CS-O-06630Fluoxetine-d5 Oxalate
CS-BX-00840Fluoxetine-d6 Oxalate
TMID-0253-01(±) -Fluoxetine-d4 Oxalate
HY-151910S1(±) -Fluoxetine-d5 Oxalate (phenyl-d5)
F211186(±)-Fluoxetine-d5 Oxalate (phenyl-d5)
HY-151910S(±) -Fluoxetine-d4 Oxalate (trifluoromethylphen-d4-oxy)
HY-B0102-01Fluoxetine

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