Vitas-M small molecule compound

5-bromo-2-(propanoylamino)benzoic acid

Catalog ID
STK223348
SMILES CCC(=O)Nc1ccc(cc1C(=O)O)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 C10H10BrNO3 MW 272.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10BrNO3/c1-2-9(13)12-8-4-3-6(11)5-7(8)10(14)15/h3-5H,2H2,1H3,(H,12,13)(H,14,15)
InChIKey
KGVFWRGFOJBDFF-UHFFFAOYSA-N
Synonyms
73721-74-1
5bromo2(propanoylamino)benzoicacid
73721741
CCC(=O)NC1=C(C=C(C=C1)Br)C(=O)O
InChI=1SC10H10BrNO3c129(13)128436(11)57(8)10(14)15h35H2H21H3(H1213)(H1415)
MFCD02767006
ZINC000004823084
ZINC4823084

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Available files

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