1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-5-(3-chlorobenzyloxy)-N,N-dimethyl-, hydrobromide
Basic information
- CAS
63979-03-3- Standard SMILES
C[NH+](C)C1CCCc2c(OCc3cccc(Cl)c3)ccc(Cl)c21.[Br-]- InChIKey
ZIBMDZPCZNQWNX-UHFFFAOYSA-N- Molecular formula
- C19H22BrCl2NO
- Average molar mass
- 431.2 g/mol
- Monoisotopic mass
- 429.02618
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-5-(3-chlorobenzyloxy)-N,N-dimethyl-, hydrobromide
- IUPAC
- [8-chloro-5-[(3-chlorophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]-dimethylazanium bromide
Names & synonyms
1-Naphthylamine, 8-chloro-5-(3-chlorobenzyl)-N,N-dimethyl-1,2,3,4-tetrahydro-, hydrobromide63979-03-31-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-5-(3-chlorobenzyloxy)-N,N-dimethyl-, hydrobromideRefChem:232377
Database identifiers
- CAS
63979-03-3- PubChem CID
- 45884
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 378
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Compound notes
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