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6-Isoquinolinol, 1,2,3,4-tetrahydro-1-(2-hydroxyphenyl)-, hydrochloride

HCID 56596
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Basic information

CAS
93203-08-8
Standard SMILES
Oc1ccc2c(c1)CC[NH2+]C2c1ccccc1O.[Cl-]
InChIKey
BEIIGTNUGIBSNP-UHFFFAOYSA-N
Molecular formula
C15H16ClNO2
Average molar mass
277.74 g/mol
Monoisotopic mass
277.0869564

Names & identifiers

Preferred name
6-Isoquinolinol, 1,2,3,4-tetrahydro-1-(2-hydroxyphenyl)-, hydrochloride
IUPAC
1-(2-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol chloride

Names & synonyms

93203-08-86-ISOQUINOLINOL, 1,2,3,4-TETRAHYDRO-1-(2-HYDROXYPHENYL)-, HYDROCHLORIDERefChem:10740101,2,3,4-Tetrahydro-1-(2-hydroxyphenyl)-6-isoquinolinol hydrochloride1-(2-Hydroxyphenyl)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline hydrochloride

Database identifiers

CAS
93203-08-8
PubChem CID
56596

Properties

Computed structural properties

Topological polar surface area
57.1 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
284

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