Basic information
- CAS
63916-85-8- Standard SMILES
CC1CCCCN1CCCOC(=O)c1cccc(O)c1- InChIKey
JKEQJSXVKIBVBU-UHFFFAOYSA-N- Molecular formula
- C16H23NO3
- Average molar mass
- 277.36 g/mol
- Monoisotopic mass
- 277.1677936
Names & identifiers
- Preferred name
- 3-(2-Methylpiperidin-1-yl)propyl 3-hydroxybenzoate
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 3-hydroxybenzoate
- English name
- 3-(2-Methylpiperidino)propyl=m-hydroxybenzoate
- Molecular formula
- C16H23NO3
- Molecular weight
- 277.36
Names & synonyms
3-(2-methylpiperidin-1-yl)propyl 3-hydroxybenzoate63916-85-8DTXSID50981032RefChem:1066567DTXCID1014083053-(2'-Methylpiperidino)propyl m-hydroxybenzoateBENZOIC ACID, m-HYDROXY-, 3-(2'-METHYLPIPERIDINO)PROPYL ESTER3-(2-Methylpiperidino)propyl=m-hydroxybenzoateBenzoic acid, 3-hydroxy-, 3-(2-methyl-1-piperidinyl)propyl ester
Database identifiers
- CAS
63916-85-8- PubChem CID
- 45247
- DTXSID
DTXSID50981032- Nikkaji
- J83.421A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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