Fluoxetine
Properties
- Molecular formula
- C17H18F3NO
- Molar mass
- 309.33 g/mol
- Exact mass
- 309.1340 Da
- Melting point
- 158 °C
- Boiling point
- 395.1 °C
- logP
- 4.43Crippen estimate
- Polar surface area
- 21.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 6
Hazards
Danger
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage100% of notifiers
- H330 Fatal if inhaled100% of notifiers
- H336 May cause drowsiness or dizziness100% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure100% of notifiers
- H410 Very toxic to aquatic life with long lasting effects100% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P302+P352, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
54910-89-3SMILES
CNCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1InChIKey
RTHCYVBBDHJXIQ-UHFFFAOYSA-NInChI
InChI=1S/C17H18F3NO/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,11-12H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
18 names · show all
- Benzenepropanamine, N-methyl-γ-[4-(trifluoromethyl)phenoxy]-
- Benzenepropanamine, N-methyl-γ-[4-(trifluoromethyl)phenoxy]-, (±)-
- N-Methyl-γ-[4-(trifluoromethyl)phenoxy]benzenepropanamine
- Dl-3-(p-Trifluoromethylphenoxy)-N-methyl-3-phenylpropylamine
- (±)-Fluoxetine
- (±)-N-Methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propylamine
- 3-(p-Trifluoromethylphenoxy)-N-methyl-3-phenylpropylamine
- Deprex
- Fluval
- NSC 283480
- N-Methyl-3-(p-trifluoromethylphenoxy)-3-phenylpropylamine
- Nikomed
- Fluoxin
- Fluoxetin ratiopharm
- Symbiax
- Seronil
- N-Methyl-3-[4-(trifluoromethyl)phenoxy]-3-phenylpropanamine
- Daforin
Work with Fluoxetine
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Atomoxetine83015-26-353 % similar
Atomoxetine hydrochloride82248-59-750 % similar
N-Methyl-γ-phenylbenzenepropanamine28075-29-845 % similar
4-(Trifluoromethyl)diphenyl ether2367-02-443 % similar
3-(Methylamino)-1-phenyl-1-propanol42142-52-942 % similar
4-(Trifluoromethyl)benzhydrol395-23-340 % similar
2-[4-(Trifluoromethyl)phenyl]pyrrolidine298690-84-338 % similar
1-Methoxy-4-(trifluoromethyl)benzene402-52-837 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.