Pyrrolidine, 3-(p-chlorobenzyl)-1-(3,4-dimethoxyphenethyl)-, hydrochloride
Basic information
- CAS
15565-29-4- Standard SMILES
COc1ccc(CCN2CCC(Cc3ccc(Cl)cc3)C2)cc1OC.Cl- InChIKey
LQNHAIRRPYBFIJ-UHFFFAOYSA-N- Molecular formula
- C21H27Cl2NO2
- Average molar mass
- 396.3 g/mol
- Monoisotopic mass
- 395.1418845
Names & identifiers
- Preferred name
- Pyrrolidine, 3-(p-chlorobenzyl)-1-(3,4-dimethoxyphenethyl)-, hydrochloride
- IUPAC
- 3-[(4-chlorophenyl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine;hydrochloride
Names & synonyms
3-(p-Chlorobenzyl)-1-(3,4-dimethoxyphenethyl)pyrrolidine hydrochloride15565-29-4Pyrrolidine, 3-(p-chlorobenzyl)-1-(3,4-dimethoxyphenethyl)-, hydrochlorideRefChem:378087DTXSID409352613-[(4-Chlorophenyl)methyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine--hydrogen chloride (1/1)
Database identifiers
- CAS
15565-29-4- PubChem CID
- 204010
- DTXSID
DTXSID40935261
Properties
Computed structural properties
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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