Basic information
- CAS
61035-93-6- Standard SMILES
CCCCCOc1ccccc1CCN.Cl- InChIKey
QZIYALJNKICYCA-UHFFFAOYSA-N- Molecular formula
- C13H22ClNO
- Average molar mass
- 243.77 g/mol
- Monoisotopic mass
- 243.138992
Names & identifiers
- Preferred name
- Benzeneethanamine, 2-(pentyloxy)-, hydrochloride
- IUPAC
- 2-(2-pentoxyphenyl)ethanamine;hydrochloride
Names & synonyms
Benzeneethanamine, 2-(pentyloxy)-, hydrochloride2-(Pentyloxy)benzeneethanamine hydrochloride61035-93-6DTXSID80209918RefChem:324580DTXCID301324092-[2-(Pentyloxy)phenyl]ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
61035-93-6- PubChem CID
- 3045708
- DTXSID
DTXSID80209918
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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