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Structure

2-Benzyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride

CAS
79677-06-8
Catalog Number
ACM79677068
Category
Other Products
Molecular Weight
457.947 g/mol
Molecular Formula
C25H28ClNO5

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Specification

Synonyms
2-benzyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride; 4,6-Isoquinolinediol,1,2,3,4-tetrahydro-2-(phenylmethyl)-1-(3,4,5-trimethoxyphenyl)-,hydrochloride,hydrate (3:3:1); 2-benzyl-1-(3,4,5-trimethoxyphenyl)-3,4-dihydro-
IUPAC Name
2-benzyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride
Canonical SMILES
COC1=CC(=CC(=C1OC)OC)C2C3=C(C=C(C=C3)O)C(C[NH+]2CC4=CC=CC=C4)O.[Cl-]
InChI Key
TVRBNZIOPHXBKR-UHFFFAOYSA-N
Boiling Point
575.8ºC at 760 mmHg
Flash Point
302ºC
Exact Mass
457.16600
H-Bond Acceptor
6
H-Bond Donor
3
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