Benzeneethanamine, 4-(4-((aminomethyl)phenyl)butyl)-, monohydrochloride
Basic information
- CAS
61022-35-3- Standard SMILES
Cl.NCCc1ccc(CCCCc2ccccc2CN)cc1- InChIKey
ZXAMJAPEOXOPGE-UHFFFAOYSA-N- Molecular formula
- C19H27ClN2
- Average molar mass
- 318.9 g/mol
- Monoisotopic mass
- 318.1862766
Names & identifiers
- Preferred name
- Benzeneethanamine, 4-(4-((aminomethyl)phenyl)butyl)-, monohydrochloride
- IUPAC
- 2-[4-[4-[2-(aminomethyl)phenyl]butyl]phenyl]ethanamine;hydrochloride
Names & synonyms
Benzeneethanamine, 4-(4-((aminomethyl)phenyl)butyl)-, monohydrochloride4-(4-((Aminomethyl)phenyl)butyl)benzeneethanamine monohydrochloride61022-35-3DTXSID00209899RefChem:324602DTXCID001323902-(4-{4-[2-(Aminomethyl)phenyl]butyl}phenyl)ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
61022-35-3- PubChem CID
- 3045691
- DTXSID
DTXSID00209899
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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