Basic information
- CAS
64037-80-5- Standard SMILES
COc1ccc(OC)c2c1CCCC2[NH3+].[Cl-]- InChIKey
ZTRZIVJXSXQHRL-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO2
- Average molar mass
- 243.73 g/mol
- Monoisotopic mass
- 243.1026065
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-5,8-dimethoxy-, hydrochloride, hemihydrate
- IUPAC
- (5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)azanium chloride
Names & synonyms
1-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-5,8-DIMETHOXY-, HYDROCHLORIDE, HEMIHYDRATE64037-80-5RefChem:10560581-Naphthylamine, 5,8-dimethoxy-1,2,3,4-tetrahydro-, hydrochloride, hemihydrate
Database identifiers
- CAS
64037-80-5- PubChem CID
- 46448
Properties
Computed structural properties
- Topological polar surface area
- 46.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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