Vitas-M small molecule compound
2-chloro-5-{5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STK018729
SMILES O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl
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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 C18H13ClO7 MW 376.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClO7/c1-18(2)25-16(22)12(17(23)26-18)8-10-4-6-14(24-10)9-3-5-13(19)11(7-9)15(20)21/h3-8H,1-2H3,(H,20,21)InChIKey
KKYNHDQGFRBQTE-UHFFFAOYSA-NSynonyms
2CHLORANYL5(5((22DIMETHYL46BIS(OXIDANYLIDENE)13DIOXAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2CHLORO5(5((22DIMETHYL46DIOXO13DIOXAN5YLIDENE)METHYL)2FURANYL)BENZOICACID
2CHLORO5(5((22DIMETHYL46DIOXO13DIOXAN5YLIDENE)METHYL)2FURYL)BENZOICACID
2CHLORO5(5((22DIMETHYL46DIOXO13DIOXAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2CHLORO5(5((46DIKETO22DIMETHYL13DIOXAN5YLIDENE)METHYL)2FURYL)BENZOICACID
5(5((22DIMETHYL46DIOXO(13DIOXAN5YLIDENE))METHYL)(2FURYL))2CHLOROBENZOICACID
CC1(OC(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)C(=O)O1)C
InChI=1SC18H13ClO7c118(2)2516(22)12(17(23)2618)8104614(2410)93513(19)11(79)15(20)21h38H12H3(H2021)
MFCD03016369
O=C1OC(C)(C)OC(=O)C1=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl
STK018729
ZINC000004505958
ZINC4505958
Check stock
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Check stock on Vitas-MAvailable files
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