Vitas-M small molecule compound

2-bromo-5-methoxy-4-propoxybenzoic acid

Catalog ID
STK500961
SMILES CCCOc1cc(Br)c(cc1OC)C(=O)O

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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 C11H13BrO4 MW 289.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13BrO4/c1-3-4-16-10-6-8(12)7(11(13)14)5-9(10)15-2/h5-6H,3-4H2,1-2H3,(H,13,14)
InChIKey
OUJMPXRIJHPUSE-UHFFFAOYSA-N
Synonyms
1024326-35-9
1024326359
2bromo5methoxy4propoxybenzoicacid
CCCOC1=C(C=C(C(=C1)Br)C(=O)O)OC
InChI=1SC11H13BrO4c134161068(12)7(11(13)14)59(10)152h56H34H212H3(H1314)
MFCD12028116
ZINC000033660186
ZINC33660186

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Available files

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