Vitas-M small molecule compound

3-bromo-4-(3-methylbutoxy)benzoic acid

Catalog ID
STL066075
SMILES CC(CCOc1ccc(cc1Br)C(=O)O)C

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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 C12H15BrO3 MW 287.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15BrO3/c1-8(2)5-6-16-11-4-3-9(12(14)15)7-10(11)13/h3-4,7-8H,5-6H2,1-2H3,(H,14,15)
InChIKey
KTCWWHPQAHQZMX-UHFFFAOYSA-N
Synonyms
881596-09-4
3bromo4(3methylbutoxy)benzoicacid
3BROMO4(ISOPENTYLOXY)BENZOICACID
CC(C)CCOC1=C(C=C(C=C1)C(=O)O)Br
Registry IDs
MFCD07183964
ZINC000008568722
ZINC8568722

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Available files

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