Vitas-M small molecule compound
3-bromo-2-(butanoylamino)-5-methylbenzoic acid
Catalog ID
STK978154
SMILES CCCC(=O)Nc1c(Br)cc(cc1C(=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 C12H14BrNO3 MW 300.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14BrNO3/c1-3-4-10(15)14-11-8(12(16)17)5-7(2)6-9(11)13/h5-6H,3-4H2,1-2H3,(H,14,15)(H,16,17)InChIKey
NEQLMJNWWCMVEB-UHFFFAOYSA-NSynonyms
1222992-44-01222992440
3bromo2(butanoylamino)5methylbenzoicacid
CCCC(=O)NC1=C(C=C(C=C1C(=O)O)C)Br
InChI=1SC12H14BrNO3c13410(15)14118(12(16)17)57(2)69(11)13h56H34H212H3(H1415)(H1617)
MFCD16604715
ZINC000044965664
ZINC44965664
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