Vitas-M small molecule compound
methyl (2E)-2-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-3-oxobutanoate
Catalog ID
STK809354
SMILES COC(=O)/C(=C/c1ccc(o1)c1cc(Cl)ccc1Cl)/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 C16H12Cl2O4 MW 339.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2O4/c1-9(19)12(16(20)21-2)8-11-4-6-15(22-11)13-7-10(17)3-5-14(13)18/h3-8H,1-2H3/b12-8+InChIKey
HPXNCGHNBVQREM-XYOKQWHBSA-NSynonyms
CC(=O)C(=CC1=CC=C(O1)C2=C(C=CC(=C2)Cl)Cl)C(=O)OC
COC(=O)C(=Cc1ccc(o1)c1cc(Cl)ccc1Cl)C(=O)C
InChI=1SC16H12Cl2O4c19(19)12(16(20)212)8114615(2211)13710(17)3514(13)18h38H12H3b128+
methyl(2E)2((5(25dichlorophenyl)furan2yl)methylidene)3oxobutanoate
MFCD03462835
ZINC000026964594
ZINC26964594
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