1,2,3,4-Tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)
Basic information
- CAS
63905-66-8- Standard SMILES
Oc1cc2c(cc1O)C[NH2+]CC2.[Cl-]- InChIKey
ZAWPXTQFHFDESR-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO2
- Average molar mass
- 201.65 g/mol
- Monoisotopic mass
- 201.0556563
Names & identifiers
- Preferred name
- 1,2,3,4-Tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)
- IUPAC
- 1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol chloride
Names & synonyms
63905-66-8DTXSID309808861,2,3,4-Tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)RefChem:1051930DTXCID9014081595,6-Dihydroxy-1,2,3,4-tetrahydroisoquinoline hydrochlorideISOQUINOLINE, 5,6-DIHYDROXY-1,2,3,4-TETRAHYDRO-, HYDROCHLORIDE
Database identifiers
- CAS
63905-66-8- PubChem CID
- 45106
Properties
Computed structural properties
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 163
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Compound notes
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