4-(4-Ethenylphenyl)butan-1-amine;hydrochloride
Basic information
- CAS
820973-58-8- Standard SMILES
C=Cc1ccc(CCCCN)cc1.Cl- InChIKey
RWYWNHSHDLDHFU-UHFFFAOYSA-N- Molecular formula
- C12H18ClN
- Average molar mass
- 211.73 g/mol
- Monoisotopic mass
- 211.1127773
Names & identifiers
- Preferred name
- 4-(4-Ethenylphenyl)butan-1-amine;hydrochloride
- IUPAC
- 4-(4-ethenylphenyl)butan-1-amine;hydrochloride
Names & synonyms
820973-58-8DTXSID608393784-(4-Ethenylphenyl)butan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
820973-58-8- PubChem CID
- 71420171
- DTXSID
DTXSID60839378
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 134
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Related reactions
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Compound notes
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