Methyl 2-isoquinolin-2-ium-1-ylacetate bromide

CAS

55841-58-2

Catalog Number

ACM55841582

Category

Other Products

Molecular Weight

282.133 g/mol

Molecular Formula

C₁₂H₁₂BrNO₂

MSDS COA Spec Sheet

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Specification

Synonyms

Isoquinolinium, methoxycarbonylmethyl-, bromide, AI3-51342, Isoquinolinium, 2-(2-methoxy-2-oxoethyl)-, bromide, ISOQUINOLINIUM, CARBOXYMETHYL-, BROMIDE, METHYL ESTER, AC1L267J, LS-86042, methyl 2-isoquinolin-2-ium-1-ylacetate bromide, 55841-58-2

IUPAC Name

methyl 2-isoquinolin-2-ium-1-ylacetate;bromide

Canonical SMILES

COC(=O)CC1=[NH+]C=CC2=CC=CC=C21.[Br-]

InChI Key

KUMUSIFXECKUCC-UHFFFAOYSA-N

Boiling Point

328ºC at 760 mmHg

Flash Point

152.2ºC

Exact Mass

281.00500

H-Bond Acceptor

H-Bond Donor

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