Basic information
- CAS
6266-97-3- Standard SMILES
COc1cc2c(cc1OC)CC(C)[NH2+]C2.[Cl-]- InChIKey
AFFAKYIZHAGJMU-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO2
- Average molar mass
- 243.73 g/mol
- Monoisotopic mass
- 243.1026065
Names & identifiers
- Preferred name
- Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-3-methyl-, hydrochloride
- IUPAC
- 6,7-dimethoxy-3-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Names & synonyms
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-3-METHYL-, HYDROCHLORIDERefChem:10877486266-97-3NSC 366611,2,3,4-Tetrahydro-6,7-dimethoxy-3-methylisoquinoline hydrochloride6,7-dimethoxy-3-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium;chloride
Database identifiers
- CAS
6266-97-3- PubChem CID
- 22643
Properties
Computed structural properties
- Topological polar surface area
- 35.1 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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