Basic information
- CAS
72279-08-4- Standard SMILES
CN(C)CCCCOc1ccccc1CCc1ccccc1O.Cl- InChIKey
SACNGQFCFZJWBT-UHFFFAOYSA-N- Molecular formula
- C20H28ClNO2
- Average molar mass
- 349.9 g/mol
- Monoisotopic mass
- 349.1808568
Names & identifiers
- Preferred name
- Phenol, 2-(2-(2-(4-(dimethylamino)butoxy)phenyl)ethyl)-, hydrochloride
- IUPAC
- 2-[2-[2-[4-(dimethylamino)butoxy]phenyl]ethyl]phenol;hydrochloride
Names & synonyms
Phenol, 2-(2-(2-(4-(dimethylamino)butoxy)phenyl)ethyl)-, hydrochloride2-(4-Dimethylaminobutoxy)-2'-hydroxybibenzyl hydrochloride72279-08-4DTXSID902225972-(2-(2-(4-(Dimethylamino)butoxy)phenyl)ethyl)phenol hydrochlorideRefChem:368972DTXCID201450882-(2-{2-[4-(Dimethylamino)butoxy]phenyl}ethyl)phenol--hydrogen chloride (1/1)
Database identifiers
- CAS
72279-08-4- PubChem CID
- 3055331
- DTXSID
DTXSID90222597
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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