(1S)-(-)-6-Hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
Basic information
- CAS
64047-43-4- Standard SMILES
COc1cc2c(cc1O)CC[NH2+]C2C.[Cl-]- InChIKey
PZZVNEZKNWRZEG-UHFFFAOYSA-N- Molecular formula
- C11H16ClNO2
- Average molar mass
- 229.7 g/mol
- Monoisotopic mass
- 229.0869564
Overview
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Names & identifiers
- Preferred name
- (1S)-(-)-6-Hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
- IUPAC
- 7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol chloride
Names & synonyms
(1S)-(-)-6-Hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride64047-43-47-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol;chloride6-Isoquinolinol, 1,2,3,4-tetrahydro-7-methoxy-1-methyl-, hydrochloride, hydrate, (1S)-(-)-, (4:1)AKOS003673602
Database identifiers
- CAS
64047-43-4- PubChem CID
- 46694
Properties
Computed structural properties
- Topological polar surface area
- 46.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 198
Related reactions
0 records
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Compound notes
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