Vitas-M small molecule compound

(2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(4-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate

Catalog ID
STK852548
SMILES COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)Cl)/C2=O)CCOC

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C22H24ClNO5 MW 417.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClNO5/c1-27-11-9-24(10-12-28-2)14-18-19(25)8-7-17-21(26)20(29-22(17)18)13-15-3-5-16(23)6-4-15/h3-8,13,25H,9-12,14H2,1-2H3/b20-13-
InChIKey
OONDYOQHFHOEJL-MOSHPQCFSA-N
Synonyms
899388-77-3
(2Z)7((bis(2methoxyethyl)ammonio)methyl)2(4chlorobenzylidene)3oxo23dihydro1benzofuran6olate
(2Z)7((bis(2methoxyethyl)azaniumyl)methyl)2((4chlorophenyl)methylidene)3oxo1benzofuran6olate
899388773
COCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1ccc(cc1)Cl)C2=O)CCOC
COCC(NH+)(CCOC)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)Cl)C2=O)(O)
InChI=1SC22H24ClNO5c12711924(1012282)141819(25)871721(26)20(2922(17)18)13153516(23)6415h381325H91214H212H3b2013
MFCD06607522
ZINC000020533228

Check stock

See real-time availability and sample size for STK852548 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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