Vitas-M small molecule compound

4-acetyl-5-(4-chlorophenyl)-3-hydroxy-1-(hydroxymethyl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STL000706
SMILES OCN1C(c2ccc(cc2)Cl)C(=C(C1=O)O)C(=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 C13H12ClNO4 MW 281.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClNO4/c1-7(17)10-11(8-2-4-9(14)5-3-8)15(6-16)13(19)12(10)18/h2-5,11,16,18H,6H2,1H3
InChIKey
SCMAYNJHIDNLTB-UHFFFAOYSA-N
Synonyms
440096-64-0
3ACETYL2(4CHLOROPHENYL)4HYDROXY1(HYDROXYMETHYL)2HPYRROL5ONE
440096640
4acetyl5(4chlorophenyl)3hydroxy1(hydroxymethyl)15dihydro2Hpyrrol2one
4acetyl5(4chlorophenyl)3hydroxy1(hydroxymethyl)1Hpyrrol2(5H)one
4ACETYL5(4CHLOROPHENYL)3HYDROXY1HYDROXYMETHYL15DIHYDROPYRROL2ONE
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)Cl)CO)O
InChI=1SC13H12ClNO4c17(17)1011(8249(14)538)15(616)13(19)12(10)18h25111618H6H21H3
MFCD02231536
ZINC000000077883
ZINC000000077890

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Available files

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