Vitas-M small molecule compound

ethyl 6-bromo-1-[(4-bromophenyl)carbonyl]-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxylate

Catalog ID
STK772755
SMILES CCOC(=O)C12C(=O)Oc3c(C1C2(C)C(=O)c1ccc(cc1)Br)cc(cc3)Br

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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 C21H16Br2O5 MW 508.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Br2O5/c1-3-27-18(25)21-16(14-10-13(23)8-9-15(14)28-19(21)26)20(21,2)17(24)11-4-6-12(22)7-5-11/h4-10,16H,3H2,1-2H3
InChIKey
DGPVGDSSBVTFIC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C12C(C1(C)C(=O)C3=CC=C(C=C3)Br)C4=C(C=CC(=C4)Br)OC2=O
ethyl6bromo1((4bromophenyl)carbonyl)1methyl2oxo17bdihydrocyclopropa(c)chromene1a(2H)carboxylate
ETHYL6BROMO1(4BROMOBENZOYL)1METHYL2OXO7BHCYCLOPROPA(C)CHROMENE1ACARBOXYLATE
InChI=1SC21H16Br2O5c132718(25)2116(141013(23)8915(14)2819(21)26)20(212)17(24)114612(22)7511h41016H3H212H3
MFCD03820702
ZINC000008869837
ZINC000245234737

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.