Isoquinoline, 3,4-dihydro-6,7-dimethoxy-1-(2-methylbutyl)-
Basic information
- CAS
20232-65-9- Standard SMILES
CCC(C)CC1=NCCc2cc(OC)c(OC)cc21- InChIKey
YOUNAVYUPVYFAI-UHFFFAOYSA-N- Molecular formula
- C16H23NO2
- Average molar mass
- 261.36 g/mol
- Monoisotopic mass
- 261.17287898
Names & identifiers
- Preferred name
- Isoquinoline, 3,4-dihydro-6,7-dimethoxy-1-(2-methylbutyl)-
- IUPAC
- 6,7-dimethoxy-1-(2-methylbutyl)-3,4-dihydroisoquinoline
Names & synonyms
20232-65-9ISOQUINOLINE, 3,4-DIHYDRO-6,7-DIMETHOXY-1-(2-METHYLBUTYL)-RefChem:10877696,7-dimethoxy-1-(2-methylbutyl)-3,4-dihydroisoquinoline3,4-Dihydro-6,7-dimethoxy-1-(2-methylbutyl)isoquinolineDTXSID30942343
Database identifiers
- CAS
20232-65-9- PubChem CID
- 30065
- DTXSID
DTXSID30942343
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 30.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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