Basic information
- CAS
5362-98-1- Standard SMILES
COc1cccc(OCCCCN2CCCC2)c1- InChIKey
PHDJCSLNNLRHCM-UHFFFAOYSA-N- Molecular formula
- C15H23NO2
- Average molar mass
- 249.35 g/mol
- Monoisotopic mass
- 249.17287898
Names & identifiers
- Preferred name
- 1-[4-(3-Methoxyphenoxy)butyl]pyrrolidine
- IUPAC
- 1-[4-(3-methoxyphenoxy)butyl]pyrrolidine
Names & synonyms
1-[4-(3-methoxyphenoxy)butyl]pyrrolidine5362-98-1CBMicro_019488DTXSID60367126CCG-7413BIM-0019345.P001AB00083054-01
Database identifiers
- CAS
5362-98-1- PubChem CID
- 2232678
- DTXSID
DTXSID60367126
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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