4-Biphenylcarboxylic acid, 3-(2-methylpiperidino)propyl ester, hydrochloride
Basic information
- CAS
73728-81-1- Standard SMILES
CC1CCCC[NH+]1CCCOC(=O)c1ccc(-c2ccccc2)cc1.[Cl-]- InChIKey
NRMJFMQYIMORDD-UHFFFAOYSA-N- Molecular formula
- C22H28ClNO2
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1808568
Names & identifiers
- Preferred name
- 4-Biphenylcarboxylic acid, 3-(2-methylpiperidino)propyl ester, hydrochloride
- IUPAC
- 3-(2-methylpiperidin-1-ium-1-yl)propyl 4-phenylbenzoate chloride
Names & synonyms
73728-81-14-BIPHENYLCARBOXYLIC ACID, 3-(2-METHYLPIPERIDINO)PROPYL ESTER, HYDROCHLORIDERefChem:290378
Database identifiers
- CAS
73728-81-1- PubChem CID
- 52334
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 397
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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