Benzeneethanamine, 4-butoxy-, hydrochloride
Basic information
- CAS
37563-52-3- Standard SMILES
CCCCOc1ccc(CCN)cc1.Cl- InChIKey
DCSXSRNHDRUYJX-UHFFFAOYSA-N- Molecular formula
- C12H20ClNO
- Average molar mass
- 229.74 g/mol
- Monoisotopic mass
- 229.123342
Names & identifiers
- Preferred name
- Benzeneethanamine, 4-butoxy-, hydrochloride
- IUPAC
- 2-(4-butoxyphenyl)ethanamine;hydrochloride
Names & synonyms
Benzeneethanamine, 4-butoxy-, hydrochloride4-Butoxybenzeneethanamine hydrochloride37563-52-3DTXSID20190997RefChem:324606DTXCID601134882-(4-Butoxyphenyl)ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
37563-52-3- PubChem CID
- 216644
- DTXSID
DTXSID20190997
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 130
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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