Basic information
- CAS
64037-86-1- Standard SMILES
COc1ccc(C(=O)CC(C)C)c2c1CCCC2[NH+](C)C.[Cl-]- InChIKey
JWMYXZOKPZMYLG-UHFFFAOYSA-N- Molecular formula
- C18H28ClNO2
- Average molar mass
- 325.9 g/mol
- Monoisotopic mass
- 325.1808568
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-N,N-dimethyl-8-isovaleryl-5-methoxy-, hydrochloride
- IUPAC
- [5-methoxy-8-(3-methylbutanoyl)-1,2,3,4-tetrahydronaphthalen-1-yl]-dimethylazanium chloride
Names & synonyms
64037-86-11-Naphthylamine, 1,2,3,4-tetrahydro-N,N-dimethyl-8-isovaleryl-5-methoxy-, hydrochloride1-Naphthylamine, N,N-dimethyl-8-isovaleryl-5-methoxy-1,2,3,4-tetrahydro-, hydrochlroideRefChem:232386
Database identifiers
- CAS
64037-86-1- PubChem CID
- 46459
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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