1-Naphthylamine, 1,2,3,4-tetrahydro-N-ethyl-5-methoxy-, hydrochloride, (S)-
Basic information
- CAS
30074-78-3- Standard SMILES
CC[NH2+][C@H]1CCCc2c(OC)cccc21.[Cl-]- InChIKey
DKRQABDXWKGWDI-YDALLXLXSA-N- Molecular formula
- C13H20ClNO
- Average molar mass
- 241.76 g/mol
- Monoisotopic mass
- 241.123342
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-N-ethyl-5-methoxy-, hydrochloride, (S)-
- IUPAC
- ethyl-[(1S)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]azanium chloride
Names & synonyms
1-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-N-ETHYL-5-METHOXY-, HYDROCHLORIDE, (S)-30074-78-3RefChem:10560861-Naphthylamine, N-ethyl-5-methoxy-1,2,3,4-tetrahydro-, hydrochloride, (S)-
Database identifiers
- CAS
30074-78-3- PubChem CID
- 34800
Properties
Computed structural properties
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 195
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Compound notes
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