1-Methyl-2-phenylpiperidine
Basic information
- CAS
36939-28-3- Standard SMILES
CN1CCCCC1c1ccccc1- InChIKey
BWKXKKCHHWEDFS-UHFFFAOYSA-N- Molecular formula
- C12H17N
- Average molar mass
- 175.27 g/mol
- Monoisotopic mass
- 175.13609955
Names & identifiers
- Preferred name
- 1-Methyl-2-phenylpiperidine
- IUPAC
- 1-methyl-2-phenylpiperidine
- English name
- 1-methyl-2-phenylpiperidine
- Molecular formula
- C12H17N
- Molecular weight
- 175.27
Names & synonyms
1-Methyl-2-phenylpiperidine36939-28-3EINECS 253-282-4NSC 129296RefChem:76245253-282-4NSC129296SCHEMBL2606118SCHEMBL4196916N-meth-ylphenyltetrahydropyridineBWKXKKCHHWEDFS-UHFFFAOYSA-NDTXSID801310842
Show more names
Piperidine, 1-methyl-2-phenyl-(2R)-1-Methyl-2β-phenylpiperidineN-Methyl-2-phenyl-D2-tetrahydropyridine
NSC-129296DB-259750NS00056720
Database identifiers
- CAS
36939-28-3- PubChem CID
- 98434
- DTXSID
DTXSID801310842- EC Number
- 253-282-4
- Nikkaji
- J260.706I
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Boiling point
- 139 °C · 139 °C(Press: 20 Torr)
- Density
- 1.0067 g/cm3 · 1.0067 g/cm3
- pka
- 9.49 · 9.49±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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