Vitas-M small molecule compound

5-iodo-2-(pentanoylamino)benzoic acid

Catalog ID
STK299783
SMILES CCCCC(=O)Nc1ccc(cc1C(=O)O)I

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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 C12H14INO3 MW 347.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14INO3/c1-2-3-4-11(15)14-10-6-5-8(13)7-9(10)12(16)17/h5-7H,2-4H2,1H3,(H,14,15)(H,16,17)
InChIKey
RITXZOCDIBSWPC-UHFFFAOYSA-N
Synonyms

5iodo2(pentanoylamino)benzoicacid
CCCCC(=O)NC1=C(C=C(C=C1)I)C(=O)O
InChI=1SC12H14INO3c123411(15)1410658(13)79(10)12(16)17h57H24H21H3(H1415)(H1617)
MFCD01797751
NVALERYL5IODOANTHRANILICACID
ZINC000005711521
ZINC5711521

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Available files

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