Vitas-M small molecule compound

2-acetylphenyl 3-bromo-4-methylbenzoate

Catalog ID
STK122461
SMILES O=C(c1ccc(c(c1)Br)C)Oc1ccccc1C(=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 C16H13BrO3 MW 333.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrO3/c1-10-7-8-12(9-14(10)17)16(19)20-15-6-4-3-5-13(15)11(2)18/h3-9H,1-2H3
InChIKey
GETZQTSDXJYKQX-UHFFFAOYSA-N
Synonyms
511516-77-1
(2ACETYLPHENYL)3BROMO4METHYLBENZOATE
2ACETYLPHENYL3BROMO4METHYLBENZOATE
511516771
CC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)C)Br
InChI=1SC16H13BrO3c1107812(914(10)17)16(19)2015643513(15)11(2)18h39H12H3
MFCD03773116
ZINC000000359010
ZINC00359010
ZINC359010

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Available files

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