Basic information
- CAS
37563-58-9- Standard SMILES
CCCCCCCCCCOc1ccc(CCN)cc1.Cl- InChIKey
BDGBXOAYXCAJMB-UHFFFAOYSA-N- Molecular formula
- C18H32ClNO
- Average molar mass
- 313.9 g/mol
- Monoisotopic mass
- 313.2172423
Names & identifiers
- Preferred name
- Benzeneethanamine, 4-(decyloxy)-, hydrochloride
- IUPAC
- 2-(4-decoxyphenyl)ethanamine;hydrochloride
Names & synonyms
4-(Decyloxy)benzeneethanamine hydrochlorideBenzeneethanamine, 4-(decyloxy)-, hydrochloride37563-58-9DTXSID80191001RefChem:324603DTXCID501134922-[4-(Decyloxy)phenyl]ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
37563-58-9- PubChem CID
- 216652
- DTXSID
DTXSID80191001
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…