Basic information
- CAS
1052506-50-9- Standard SMILES
COC(=O)COc1ccc(CNC2CCCCCCC2)cc1.Cl- InChIKey
SFVWSUVQMYDUES-UHFFFAOYSA-N- Molecular formula
- C18H28ClNO3
- Average molar mass
- 341.9 g/mol
- Monoisotopic mass
- 341.1757714
Names & identifiers
- Preferred name
- Methyl 2-[4-[(cyclooctylamino)methyl]phenoxy]acetate;hydrochloride
- IUPAC
- methyl 2-[4-[(cyclooctylamino)methyl]phenoxy]acetate;hydrochloride
Names & synonyms
methyl {4-[(cyclooctylamino)methyl]phenoxy}acetate hydrochloridemethyl 2-[4-[(cyclooctylamino)methyl]phenoxy]acetate;hydrochloride1052506-50-9SR-01000283287SR-01000283287-1
Database identifiers
- CAS
1052506-50-9- PubChem CID
- 2962437
Properties
Computed structural properties
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 305
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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