Basic information
- CAS
64050-40-4- Standard SMILES
CC1CCCCN1CCCOC(=O)c1ccc(Oc2ccccc2)cc1- InChIKey
HNUAVHJUFYQQEO-UHFFFAOYSA-N- Molecular formula
- C22H27NO3
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.19909372
Names & identifiers
- Preferred name
- 3-(2-Methylpiperidin-1-yl)propyl 4-phenoxybenzoate
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 4-phenoxybenzoate
- English name
- 3-(2-Methylpiperidino)propyl=p-phenoxybenzoate
- Molecular formula
- C22H27NO3
- Molecular weight
- 353.45
Names & synonyms
3-(2-methylpiperidin-1-yl)propyl 4-phenoxybenzoate64050-40-4DTXSID30982401RefChem:1066594DTXCID9014096643-(2'-Methylpiperidino)propyl p-phenoxybenzoateBENZOIC ACID, p-PHENOXY-, 3-(2'-METHYLPIPERIDINO)PROPYL ESTER3-(2-Methylpiperidino)propyl=p-phenoxybenzoateBenzoic acid, 4-phenoxy-, 3-(2-methyl-1-piperidinyl)propyl ester
Database identifiers
- CAS
64050-40-4- PubChem CID
- 47008
- DTXSID
DTXSID30982401- Nikkaji
- J83.486F
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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