Basic information
- CAS
50634-93-0- Standard SMILES
COc1cccc2c1OC(C[NH2+]CCCc1ccccc1)C2.[Cl-]- InChIKey
KGBXFYDAOLABAC-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO2
- Average molar mass
- 333.8 g/mol
- Monoisotopic mass
- 333.1495567
Names & identifiers
- Preferred name
- 2-Benzofuranmethylamine, 2,3-dihydro-7-methoxy-N-(3-phenylpropyl)-, monohydrochloride
- IUPAC
- (7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl-(3-phenylpropyl)azanium chloride
Names & synonyms
50634-93-02,3-Dihydro-7-methoxy-N-(3-phenylpropyl)-2-benzofuranmethylamine hydrochloride2-Benzofuranmethylamine, 2,3-dihydro-7-methoxy-N-(3-phenylpropyl)-, monohydrochlorideRefChem:256374
Database identifiers
- CAS
50634-93-0- PubChem CID
- 39747
Properties
Computed structural properties
- Topological polar surface area
- 35.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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