4-(1,3-Benzodioxol-5-ylmethyl)-6,7-dimethoxyisoquinolin-2-ium;methanesulfonate

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Catalog Number
ACM61189955
Product Name
4-(1,3-Benzodioxol-5-ylmethyl)-6,7-dimethoxyisoquinolin-2-ium;methanesulfonate
CAS
61189-95-5
Category
Heterocyclic Organic Compound
Synonyms
CID43573, LS-85579, 6,7-Dimethoxy-4-(3,4-methylenedioxybenzyl)isoquinoline methanesulfonate, ISOQUINOLINE, 6,7-DIMETHOXY-4-(3,4-METHYLENEDIOXYBENZYL)-, METHANESULFONATE, 61189-95-5
IUPAC Name
4-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxyisoquinolin-2-ium; methanesulfonate
Molecular Weight
419.448 g/mol
Molecular Formula
C20H21NO7S
Canonical SMILES
COC1=C(C=C2C(=C1)C=[NH+]C=C2CC3=CC4=C(C=C3)OCO4)OC.CS(=O)(=O)[O-]
InChI Key
GDLKKPBIESAWHJ-UHFFFAOYSA-N
Boiling Point
497.9ºC at 760 mmHg
Flash Point
176.8ºC
Exact Mass
419.10400
H-Bond Acceptor
7
H-Bond Donor
1
MSDS
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COA
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Spec Sheet
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