Basic information
- CAS
71825-26-8- Standard SMILES
NCCCCCCc1ccc([NH+]2CCCCC2)cc1.O=C([O-])CCC(=O)O- InChIKey
CYWRFMLHVGCNHJ-UHFFFAOYSA-N- Molecular formula
- C21H34N2O4
- Average molar mass
- 378.5 g/mol
- Monoisotopic mass
- 378.25185757
Names & identifiers
- Preferred name
- Hexylamine, 6-(4-piperidinophenyl)-, succinate
- IUPAC
- 4-hydroxy-4-oxobutanoate;6-(4-piperidin-1-ium-1-ylphenyl)hexan-1-amine
Names & synonyms
6-(4-Piperidinophenyl)hexylamine succinateHEXYLAMINE, 6-(4-PIPERIDINOPHENYL)-, SUCCINATE71825-26-8RefChem:347809
Database identifiers
- CAS
71825-26-8- PubChem CID
- 51435
Properties
Computed structural properties
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…