Structure

5-[2-(3,4-Dichlorophenyl)ethyl]-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride

CAS
63937-51-9
Catalog Number
ACM63937519
Category
Other Products
Molecular Weight
400.727 g/mol
Molecular Formula
C19H20Cl3NO2

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Specification

Synonyms
CID45485, LS-85886, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-1-(3,4-DICHLOROPHENETHYL)-2-METHYL-6,7-METHYLEN, 63937-51-9, Isoquinoline, 1,2,3,4-tetrahydro-1-(3,4-dichlorophenethyl)-2-methyl-6,7-methylenedioxy-, hydrochloride
IUPAC Name
5-[2-(3,4-dichlorophenyl)ethyl]-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
SMILES
C[NH+]1CCC2=CC3=C(C=C2C1CCC4=CC(=C(C=C4)Cl)Cl)OCO3.[Cl-]
InChI Key
HGUSSAFZFOSXOC-UHFFFAOYSA-N
Boiling Point
464.6ºC at 760 mmHg
Flash Point
234.8ºC
Exact Mass
399.05600
H-Bond Acceptor
3
H-Bond Donor
1

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