Vitas-M small molecule compound

4-[(2-acetylphenyl)amino]-4-oxobutanoic acid

Catalog ID
STL508887
SMILES OC(=O)CCC(=O)Nc1ccccc1C(=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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c1-8(14)9-4-2-3-5-10(9)13-11(15)6-7-12(16)17/h2-5H,6-7H2,1H3,(H,13,15)(H,16,17)
InChIKey
AJFVLYLOGPQKGZ-UHFFFAOYSA-N
Synonyms
41242-37-9
(CARBOXY3PROPIONAMIDO)2ACETOPHENONE
(CARBOXY3PROPIONAMIDO)2ACETOPHENONE(FRENCH)
3((2ACETYLPHENYL)CARBAMOYL)PROPANOICACID
3027728
4((2acetylphenyl)amino)4oxobutanoicacid
4(2ACETYLANILINO)4OXOBUTANOICACID
41242379
BUTANOICACID4((2ACETYLPHENYL)AMINO)4OXO
InChI=1SC12H13NO4c18(14)9423510(9)1311(15)6712(16)17h25H67H21H3(H1315)(H1617)
MFCD01751603
ZINC000011947360

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Available files

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