Basic information
- CAS
63978-96-1- Standard SMILES
COc1ccc(C(C)=O)c2c1CCCC2N(C)C- InChIKey
LZGNSTGYPLIUIX-UHFFFAOYSA-N- Molecular formula
- C15H21NO2
- Average molar mass
- 247.33 g/mol
- Monoisotopic mass
- 247.15722891
Names & identifiers
- Preferred name
- 1-Naphthylamine, 1,2,3,4-tetrahydro-8-acetyl-N,N-dimethyl-5-methoxy-
- IUPAC
- 1-[8-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone
Names & synonyms
BRN 21278681-Naphthylamine, 8-acetyl-N,N-dimethyl-5-methoxy-1,2,3,4-tetrahydro-63978-96-11'-Acetonaphthone, 5',6',7',8'-tetrahydro-8'-(dimethylamino)-4'-methoxy-1-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-8-ACETYL-N,N-DIMETHYL-5-METHOXY-RefChem:232375DTXSID609815081-[8-(Dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]ethan-1-one
Database identifiers
- CAS
63978-96-1- PubChem CID
- 45874
- DTXSID
DTXSID60981508- Nikkaji
- J61.704K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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