3-(3-Fluorophenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine--hydrogen chloride (1/1)
Basic information
- CAS
21165-49-1- Standard SMILES
CN(C)CC=C(c1ccccc1)c1cccc(F)c1.Cl- InChIKey
NBBYUWQRZGTKFI-UHFFFAOYSA-N- Molecular formula
- C17H19ClFN
- Average molar mass
- 291.8 g/mol
- Monoisotopic mass
- 291.1190055
Names & identifiers
- Preferred name
- 3-(3-Fluorophenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine--hydrogen chloride (1/1)
- IUPAC
- 3-(3-fluorophenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine;hydrochloride
- English name
- 1-(m-Fluorophenyl)-1-phenyl-3-dimethylaminoprop-1-ene hydrochloride
- Molecular formula
- C17H18FN.ClH
- Molecular weight
- 291.79
Names & synonyms
DTXSID609434893-(3-Fluorophenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine--hydrogen chloride (1/1)RefChem:1066704DTXCID00137185421165-49-11-(m-Fluorophenyl)-1-phenyl-3-dimethylaminoprop-1-ene hydrochloridePropene, 3-(dimethylamino)-1-(m-fluorophenyl)-1-phenyl-, hydrochloride2-Propen-1-amine, N,N-dimethyl-3-(m-fluorophenyl)-3-phenyl-, hydrochloride
Database identifiers
- CAS
21165-49-1- PubChem CID
- 89444
- DTXSID
DTXSID60943489
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 292
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Compound notes
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