Vitas-M small molecule compound

4-(pentanoylamino)benzoic acid

Catalog ID
STK414812
SMILES CCCCC(=O)Nc1ccc(cc1)C(=O)O

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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 C12H15NO3 MW 221.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15NO3/c1-2-3-4-11(14)13-10-7-5-9(6-8-10)12(15)16/h5-8H,2-4H2,1H3,(H,13,14)(H,15,16)
InChIKey
SBQFPXHBAJDVLV-UHFFFAOYSA-N
Synonyms
100390-76-9
100390769
4(pentanoylamino)benzoicacid
4PENTANAMIDOBENZOICACID
CCCCC(=O)NC1=CC=C(C=C1)C(=O)O
InChI=1SC12H15NO3c123411(14)1310759(6810)12(15)16h58H24H21H3(H1314)(H1516)
MFCD01365923
ZINC000007260906
ZINC7260906

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Available files

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