Vitas-M small molecule compound

5-{[(3-fluorophenyl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione

Catalog ID
STK839661
SMILES Fc1cccc(c1)NC=C1C(=O)OC(OC1=O)(C)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 C13H12FNO4 MW 265.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12FNO4/c1-13(2)18-11(16)10(12(17)19-13)7-15-9-5-3-4-8(14)6-9/h3-7,15H,1-2H3
InChIKey
OSEZEAKECQZFAJ-UHFFFAOYSA-N
Synonyms
25063-54-1
25063541
5(((3FLUOROPHENYL)AMINO)METHYLENE)22DIMETHYL13DIOXANE46DIONE
5(((3fluorophenyl)amino)methylidene)22dimethyl13dioxane46dione
5((3FLUOROANILINO)METHYLIDENE)22DIMETHYL13DIOXANE46DIONE
CC1(OC(=O)C(=CNC2=CC(=CC=C2)F)C(=O)O1)C
InChI=1SC13H12FNO4c113(2)1811(16)10(12(17)1913)71595348(14)69h3715H12H3
MFCD02936587
ZINC000000215633
ZINC00215633
ZINC215633

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Available files

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