6-Hydroxy-1,2,3,4-tetrahydroisoquinolinium chloride
Basic information
- CAS
63905-73-7- Standard SMILES
Oc1ccc2c(c1)CC[NH2+]C2.[Cl-]- InChIKey
KKZTXWVJZMVLFG-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO
- Average molar mass
- 185.65 g/mol
- Monoisotopic mass
- 185.0607417
Overview
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Names & identifiers
- Preferred name
- 6-Hydroxy-1,2,3,4-tetrahydroisoquinolinium chloride
- IUPAC
- 1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol chloride
- English name
- 1,2,3,4-Tetrahydro-isoquinolin-6-ol Hydrochloride
- Molecular formula
- C9H12ClNO
- Molecular weight
- 185.65068
Names & synonyms
6-hydroxy-1,2,3,4-tetrahydroisoquinolinium chloride6-Hydroxy-1,2,3,4-tetrahydroisoquinoline hydrochloride1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol;chloride1,2,3,4-Tetrahydro-6-isoquinolinol hydrochloride1,2,3,4-Tetrahydro-isoquinolin-6-ol Hydrochloride
Database identifiers
- CAS
63905-73-7- PubChem CID
- 45117
Properties
Computed structural properties
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 138
Physicochemical properties
- Melting point
- 222 · 222-224℃
- storage temp.
- Inert atmosphere,Room Temperature
Chemistry & industry
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