1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N-ethyl-5-methoxy-, hydrochloride, (S)-
Basic information
- CAS
30074-75-0- Standard SMILES
CC[NH2+][C@H]1CCCc2c(OC)ccc(Cl)c21.[Cl-]- InChIKey
NXHSMFLYZRLVOC-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-ethyl-5-methoxy-, hydrochloride, (S)-
- IUPAC
- [(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-ethylazanium chloride
Names & synonyms
1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N-ethyl-5-methoxy-, hydrochloride, (S)-30074-75-0RefChem:10560741-Naphthylamine, 8-chloro-N-ethyl-5-methoxy-1,2,3,4-tetrahydro-, hydrochloride, (S)-
Database identifiers
- CAS
30074-75-0- PubChem CID
- 34794
Properties
Computed structural properties
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 224
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Compound notes
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