Basic information
- CAS
63867-24-3- Standard SMILES
CCC(C(=O)OCCCN1CCCCC1C)c1ccccc1- InChIKey
GMKRJJQRDLKNHL-UHFFFAOYSA-N- Molecular formula
- C19H29NO2
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.21982917
Names & identifiers
- Preferred name
- Butyric acid, 2-phenyl-, 3-(2''-methylpiperidino)propyl ester
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 2-phenylbutanoate
- English name
- 2-Phenylbutyric acid 3-(2-methylpiperidino)propyl ester
- Molecular formula
- C19H29NO2
- Molecular weight
- 303.44
Names & synonyms
63867-24-3BUTYRIC ACID, 2-PHENYL-, 3-(2''-METHYLPIPERIDINO)PROPYL ESTERRefChem:10804693-(2'-Methylpiperidino)propyl 2-phenylbutyrate3-(2-methylpiperidin-1-yl)propyl 2-phenylbutanoate2-Phenylbutyric acid 3-(2-methylpiperidino)propyl esterDTXSID60980511DB-303640Benzeneacetic acid, α-ethyl-, 3-(2-methyl-1-piperidinyl)propyl ester
Database identifiers
- CAS
63867-24-3- PubChem CID
- 44859
- DTXSID
DTXSID60980511- Nikkaji
- J67.404D
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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