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Fluoxetine hydrochloride

CAT: 0926-FF23496-01Size: 250 gDry Ice: NoHazardous: No
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CAT#:0926-FF23496-01Size:250 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
56296-78-7
Synonyms
N-Methyl-γ-[4- (trifluoromethyl) phenoxy]benzenepropanamine hydrochloride; (+/-) -N-Methyl-3-phenyl-3-[4- (trifluoromethyl) phenoxy]propyl amine hydrochloride; Adofen
MDL Number
MFCD00214288
Smiles
CNCCC (C1=CC=CC=C1) OC2=CC=C (C=C2) C (F) (F) F.Cl
Molecular Formula
C17H19ClF3NO
Molecular Weight
345.79 g/mol
Controlled
No

Chemical Information

Reconcile

N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]-1-propanamine hydrochloride (1:1) is a hydrochloride and a N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine.

CAS Number56296-78-7
PubChem CID62857
IUPAC NameN-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine;hydrochloride
Molecular FormulaC17H19ClF3NO
Molecular Weight345.8
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity308
SMILES
CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F.Cl
InChI
InChI=1S/C17H18F3NO.ClH/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20;/h2-10,16,21H,11-12H2,1H3;1H
InChIKey
GIYXAJPCNFJEHY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Reconcile
CAS: 56296-78-7
CID: 62857
Formula: C17H19ClF3NO
MW: 345.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight345.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass345.1107264
Monoisotopic Mass345.1107264
Topological Polar Surface Area21.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity308
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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