Pyridine, 1,2,3,6-tetrahydro-1,5-dimethyl-4-phenyl-, hydrochloride
Basic information
- CAS
6672-58-8- Standard SMILES
CC1=C(c2ccccc2)CCN(C)C1.Cl- InChIKey
NZCUTXGXXPTHEH-UHFFFAOYSA-N- Molecular formula
- C13H18ClN
- Average molar mass
- 223.74 g/mol
- Monoisotopic mass
- 223.1127773
Names & identifiers
- Preferred name
- Pyridine, 1,2,3,6-tetrahydro-1,5-dimethyl-4-phenyl-, hydrochloride
- IUPAC
- 1,5-dimethyl-4-phenyl-3,6-dihydro-2H-pyridine;hydrochloride
Names & synonyms
Pyridine, 1,2,3,6-tetrahydro-1,5-dimethyl-4-phenyl-, hydrochloride6672-58-81,2,3,6-Tetrahydro-1,5-dimethyl-4-phenylpyridine hydrochlorideCHEMBL538783DTXSID102168571,5-Dimethyl-4-phenyl-1,2,3,6-tetrahydropyridine--hydrogen chloride (1/1)
Database identifiers
- CAS
6672-58-8- PubChem CID
- 3014516
- DTXSID
DTXSID10216857- ChEMBL
CHEMBL538783
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…