Vitas-M small molecule compound

3-acetyl-2-[(5-chloro-2-hydroxyphenyl)amino]-6-methyl-4H-pyran-4-one

Catalog ID
STK966185
SMILES Clc1ccc(c(c1)Nc1oc(C)cc(=O)c1C(=O)C)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 C14H12ClNO4 MW 293.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClNO4/c1-7-5-12(19)13(8(2)17)14(20-7)16-10-6-9(15)3-4-11(10)18/h3-6,16,18H,1-2H3
InChIKey
CBGKEBDXUYYDDZ-UHFFFAOYSA-N
Synonyms

3acetyl2((5chloro2hydroxyphenyl)amino)6methyl4Hpyran4one
3ACETYL2((5CHLORO2HYDROXYPHENYL)AMINO)6METHYL4OXOPYRAN
3ACETYL2(5CHLORO2HYDROXYANILINO)6METHYLPYRAN4ONE
CC1=CC(=O)C(=C(O1)NC2=C(C=CC(=C2)Cl)O)C(=O)C
InChI=1SC14H12ClNO4c17512(19)13(8(2)17)14(207)161069(15)3411(10)18h361618H12H3
MFCD03765048
ZINC000006500515
ZINC06500515
ZINC6500515

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Available files

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