Basic information
- CAS
30074-65-8- Standard SMILES
COc1ccc(Cl)c2c1CCC[C@@H]2[NH+](C)C.[Cl-]- InChIKey
XYTNPORBXPAQMP-MERQFXBCSA-N- Molecular formula
- C13H19Cl2NO
- Average molar mass
- 276.2 g/mol
- Monoisotopic mass
- 275.0843696
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N,N-dimethyl-5-methoxy-, hydrochloride, (S)-
- IUPAC
- [(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-dimethylazanium chloride
Names & synonyms
1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N,N-dimethyl-5-methoxy-, hydrochloride, (S)-RefChem:105607230074-65-81-Naphthylamine, 8-chloro-N,N-dimethyl-5-methoxy-1,2,3,4-tetrahydro- hydrochloride, (S)-
Database identifiers
- CAS
30074-65-8- PubChem CID
- 34786
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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