3-[3-(Trifluoromethyl)phenoxy]piperidine
Basic information
- CAS
946759-18-8- Standard SMILES
FC(F)(F)c1cccc(OC2CCCNC2)c1- InChIKey
AFCIGAUDFUCOEQ-UHFFFAOYSA-N- Molecular formula
- C12H14F3NO
- Average molar mass
- 245.24 g/mol
- Monoisotopic mass
- 245.10274856
Names & identifiers
- Preferred name
- 3-[3-(Trifluoromethyl)phenoxy]piperidine
- IUPAC
- 3-[3-(trifluoromethyl)phenoxy]piperidine
- English name
- 3-[3-(Trifluoromethyl)phenoxy]piperidine
- Molecular formula
- C12H14F3NO
- Molecular weight
- 245.24
Names & synonyms
3-[3-(Trifluoromethyl)phenoxy]piperidine946759-18-83-(3-(Trifluoromethyl)phenoxy)piperidine4127AFDTXSID20663030MFCD08688558AKOS010951309AS-95432CS-0269218Piperidine, 3-[3-(trifluoromethyl)phenoxy]-F83426EN300-1937826
Show more names
F678968A1-45955
Database identifiers
- CAS
946759-18-8- PubChem CID
- 45075405
- DTXSID
DTXSID20663030
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- Colorless to light yellow Viscous Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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