Basic information
- CAS
63766-12-1- Standard SMILES
COc1c(Cl)ccc2c1CCCC2C(O)[NH+](C)C.[Br-]- InChIKey
PKFLRMGRLBJGHH-UHFFFAOYSA-N- Molecular formula
- C14H21BrClNO2
- Average molar mass
- 350.68 g/mol
- Monoisotopic mass
- 349.04442
Names & identifiers
- Preferred name
- (6-Chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)(dimethylamino)methanol--hydrogen bromide (1/1)
- IUPAC
- [(6-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-hydroxymethyl]-dimethylazanium bromide
Names & synonyms
63766-12-1DTXSID50980323(6-Chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)(dimethylamino)methanol--hydrogen bromide (1/1)RefChem:1050655DTXCID4014076011-Naphthalenemethanol, 1,2,3,4-tetrahydro-6-chloro-1-(dimethylamino)-5-methoxy-, hydrobromide
Database identifiers
- CAS
63766-12-1- PubChem CID
- 44718
Properties
Computed structural properties
- Topological polar surface area
- 33.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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