Vitas-M small molecule compound

diethyl [(E)-({[(3-chlorophenyl)carbonyl]oxy}imino)(cyano)methyl]phosphonate

Catalog ID
STL563188
SMILES CCOP(=O)(/C(=N/OC(=O)c1cccc(c1)Cl)/C#N)OCC

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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 C13H14ClN2O5P MW 344.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClN2O5P/c1-3-19-22(18,20-4-2)12(9-15)16-21-13(17)10-6-5-7-11(14)8-10/h5-8H,3-4H2,1-2H3/b16-12+
InChIKey
MTBLPFYVSIBXGW-FOWTUZBSSA-N
Synonyms

((E)(cyano(diethoxyphosphoryl)methylidene)amino)3chlorobenzoate
(E)diethyl((((3chlorobenzoyl)oxy)imino)(cyano)methyl)phosphonate
6881623
CCOP(=O)(C(=NOC(=O)c1cccc(c1)Cl)C#N)OCC
diethyl((E)((((3chlorophenyl)carbonyl)oxy)imino)(cyano)methyl)phosphonate
InChI=1SC13H14ClN2O5Pc131922(182042)12(915)162113(17)1065711(14)810h58H34H212H3b1612+
MFCD01852107
ZINC000002266412

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Available files

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