1-Methyl-4-(5-(trifluoromethyl)pyridin-2-yl)piperazine
Basic information
- CAS
192564-53-7- Standard SMILES
CN1CCN(c2ccc(C(F)(F)F)cn2)CC1- InChIKey
BOIFDXWRPSEUMD-UHFFFAOYSA-N- Molecular formula
- C11H14F3N3
- Average molar mass
- 245.24 g/mol
- Monoisotopic mass
- 245.11398195
Names & identifiers
- Preferred name
- 1-Methyl-4-(5-(trifluoromethyl)pyridin-2-yl)piperazine
- IUPAC
- 1-methyl-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine
- English name
- 1-Methyl-4-(5-(trifluoromethyl)pyridin-2-yl)piperazine
- Molecular formula
- C11H14F3N3
- Molecular weight
- 245.24
Names & synonyms
192564-53-71-Methyl-4-(5-(trifluoromethyl)pyridin-2-yl)piperazine2-(4-Methylpiperazino)-5-trifluoromethylpyridine1-methyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazineMFCD00839913Piperazine, 1-methyl-4-[5-(trifluoromethyl)-2-pyridinyl]-1-methyl-4-[5-(trifluoromethyl)-2-pyridinyl]piperazineAF-399/32018043SCHEMBL8082196DTXSID10356702BOIFDXWRPSEUMD-UHFFFAOYSA-NAKOS001175726
Show more names
BS-21988DB-354864CS-0212891AE-848/32609040SR-01000305141SR-01000305141-11-methyl-4-[5-(trifluoromethyl)-2-pyridyl]piperazineZ31193760
Database identifiers
- CAS
192564-53-7- PubChem CID
- 829355
- DTXSID
DTXSID10356702- Nikkaji
- J2.764.089C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 19.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Boiling point
- 312.1 · 312.1±42.0 °C(Predicted)
- Density
- 1.229 · 1.229±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 7.16 · 7.16±0.42(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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 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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