Vitas-M small molecule compound

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

Catalog ID
STL067718
SMILES O=C(NCc1ccccc1Cl)CCC(=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 C11H12ClNO3 MW 241.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12ClNO3/c12-9-4-2-1-3-8(9)7-13-10(14)5-6-11(15)16/h1-4H,5-7H2,(H,13,14)(H,15,16)
InChIKey
NZLYKZUNHUYCRU-UHFFFAOYSA-N
Synonyms
904785-49-5
3(((2CHLOROPHENYL)METHYL)CARBAMOYL)PROPANOICACID
3(N((2CHLOROPHENYL)METHYL)CARBAMOYL)PROPANOICACID
4((2chlorobenzyl)amino)4oxobutanoicacid
4((2CHLOROPHENYL)METHYLAMINO)4OXOBUTANOICACID
904785495
C1=CC=C(C(=C1)CNC(=O)CCC(=O)O)Cl
InChI=1SC11H12ClNO3c12942138(9)71310(14)5611(15)16h14H57H2(H1314)(H1516)
MFCD06065162
ZINC000008021075
ZINC8021075

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Available files

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