3-(2-(Benzyloxy)phenoxy)propan-1-amine hydrochloride
Basic information
- CAS
100840-68-4- Standard SMILES
Cl.NCCCOc1ccccc1OCc1ccccc1- InChIKey
XRMUBDDZFXBLHO-UHFFFAOYSA-N- Molecular formula
- C16H20ClNO2
- Average molar mass
- 293.79 g/mol
- Monoisotopic mass
- 293.1182566
Names & identifiers
- Preferred name
- 3-(2-(Benzyloxy)phenoxy)propan-1-amine hydrochloride
- IUPAC
- 3-(2-phenylmethoxyphenoxy)propan-1-amine;hydrochloride
Names & synonyms
3-(2-(Benzyloxy)phenoxy)propan-1-amine hydrochloride100840-68-4DTXSID401384744A1-451701-Propanamine, 3-[2-(phenylmethoxy)phenoxy]-, hydrochloride (1:1)
Database identifiers
- CAS
100840-68-4- PubChem CID
- 85522380
- DTXSID
DTXSID401384744
Properties
Computed structural properties
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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