4,7,8-trihydroxy-3,4-dihydro-2H-isoquinolin-2-ium-1-one chloride

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Catalog Number
ACM101670580
Product Name
4,7,8-trihydroxy-3,4-dihydro-2H-isoquinolin-2-ium-1-one chloride
Structure
Structure
CAS
101670-58-0
Category
Heterocyclic Organic Compound
Synonyms
P 15, 4,7,8-trihydroxy-1-oxo-1,2,3,4-tetrahydroisoquinolinium chloride, ISOQUINOLIN-1-ONE, 1,2,3,4-TETRAHYDRO-4,7,8-TRIHYDROXY-, HYDROCHLORIDE, 101670-58-0, AC1L1PKY, AC1Q1SMP, LS-86251, 4,7,8-trihydroxy-3,4-dihydro-2H-isoquinolin-2-ium-1-one chloride
IUPAC Name
4,7,8-trihydroxy-3,4-dihydro-2H-isoquinolin-2-ium-1-one;chloride
Molecular Weight
231.633 g/mol
Molecular Formula
C9H10ClNO4
Canonical SMILES
C1C(C2=C(C(=C(C=C2)O)O)C(=O)[NH2+]1)O.[Cl-]
InChI Key
BMNBFRJBYVIOAY-UHFFFAOYSA-N
Boiling Point
608.4ºC at 760mmHg
Flash Point
321.8ºC
Exact Mass
231.03000
H-Bond Acceptor
5
H-Bond Donor
4
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