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Merck
CN

550310

6-Bromo-3-cyano-4-methylcoumarin

97%

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About This Item

Linear Formula:
C6H3BrC4H3O2CN
CAS Number:
Molecular Weight:
264.07
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
Form:
solid
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assay

97%

form

solid

mp

186-190 °C (lit.)

SMILES string

CC1=C(C#N)C(=O)Oc2ccc(Br)cc12

InChI

1S/C11H6BrNO2/c1-6-8-4-7(12)2-3-10(8)15-11(14)9(6)5-13/h2-4H,1H3

InChI key

NPCFOYALAZMRDI-UHFFFAOYSA-N

General description

6-Bromo-3-cyano-4-methylcoumarin is a 3-cyanocoumarin derivative, which constitutes an important class of heterocycle for preparing methine dyes and bioactive compounds. It can be prepared by reacting 5′-bromo-2′-hydroxyacetophenone with malononitrile in the presence of iodine under microwave or thermal conditions.


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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