Vitas-M small molecule compound

methyl (2Z)-3-{5-bromo-2-[(2,6-dichlorobenzyl)oxy]phenyl}-2-cyanoprop-2-enoate

Catalog ID
STK454685
SMILES N#C/C(=C/c1cc(Br)ccc1OCc1c(Cl)cccc1Cl)/C(=O)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H12BrCl2NO3 MW 441.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrCl2NO3/c1-24-18(23)12(9-22)7-11-8-13(19)5-6-17(11)25-10-14-15(20)3-2-4-16(14)21/h2-8H,10H2,1H3/b12-7-
InChIKey
CAYNAJWTYITITQ-GHXNOFRVSA-N
Synonyms

COC(=O)C(=CC1=C(C=CC(=C1)Br)OCC2=C(C=CC=C2Cl)Cl)C#N
InChI=1SC18H12BrCl2NO3c12418(23)12(922)711813(19)5617(11)25101415(20)32416(14)21h28H10H21H3b127
METHYL(2Z)3(2((26DICHLOROPHENYL)METHOXY)5BROMOPHENYL)2CYANOPROP2ENOATE
methyl(2Z)3(5bromo2((26dichlorobenzyl)oxy)phenyl)2cyanoprop2enoate
methyl(Z)3(5bromo2((26dichlorophenyl)methoxy)phenyl)2cyanoprop2enoate
MFCD04227614
N#CC(=Cc1cc(Br)ccc1OCc1c(Cl)cccc1Cl)C(=O)OC
ZINC000019633096
ZINC19633096

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Available files

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