Vitas-M small molecule compound
ethyl (2E)-2-(4-chlorobenzylidene)-3-oxobutanoate
Catalog ID
STK820866
SMILES CCOC(=O)/C(=C/c1ccc(cc1)Cl)/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 C13H13ClO3 MW 252.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClO3/c1-3-17-13(16)12(9(2)15)8-10-4-6-11(14)7-5-10/h4-8H,3H2,1-2H3/b12-8+InChIKey
SGLZOEHATVEHGH-XYOKQWHBSA-NSynonyms
2(4CHLOROBENZYLIDENE)ACETOACETICACIDETHYLESTER
CCOC(=O)C(=CC1=CC=C(C=C1)Cl)C(=O)C
CCOC(=O)C(=Cc1ccc(cc1)Cl)C(=O)C
ETHYL(2E)2((4CHLOROPHENYL)METHYLENE)3OXOBUTANOATE
ETHYL(2E)2((4CHLOROPHENYL)METHYLIDENE)3OXOBUTANOATE
ethyl(2E)2(4chlorobenzylidene)3oxobutanoate
ETHYL(2E)2ACETYL3(4CHLOROPHENYL)PROP2ENOATE
ETHYL2(4CHLOROBENZYLIDENE)3OXOBUTANOATE
ETHYL2ACETYL3(4CHLOROPHENYL)ACRYLATE
InChI=1SC13H13ClO3c131713(16)12(9(2)15)8104611(14)7510h48H3H212H3b128+
MFCD00858200
ZINC000000016518
ZINC00016518
ZINC16518
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