Vitas-M small molecule compound
dimethyl 5-isothiocyanatobenzene-1,3-dicarboxylate
Catalog ID
STK784779
SMILES S=C=Nc1cc(cc(c1)C(=O)OC)C(=O)OC
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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 C11H9NO4S MW 251.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9NO4S/c1-15-10(13)7-3-8(11(14)16-2)5-9(4-7)12-6-17/h3-5H,1-2H3InChIKey
SEFVBTNZOHDLLS-UHFFFAOYSA-NSynonyms
72076-50-713BENZENEDICARBOXYLICACID5ISOTHIOCYANATO13DIMETHYLESTER
13BENZENEDICARBOXYLICACID5ISOTHIOCYANATODIMETHYLESTER
13DIMETHYL5ISOTHIOCYANATOBENZENE13DICARBOXYLATE
5ISOTHIOCYANATO13BENZENEDICARBOXYLICACIDDIMETHYLESTER
5ISOTHIOCYANATOISOPHTHALICACIDDIMETHYLESTER
72076507
COC(=O)C1=CC(=CC(=C1)N=C=S)C(=O)OC
DIMETHYL5ISOTHIOCYANATO13BENZENEDICARBOXYLATE
dimethyl5isothiocyanatobenzene13dicarboxylate
DIMETHYL5ISOTHIOCYANATOISOPHTHALATE
InChI=1SC11H9NO4Sc11510(13)738(11(14)162)59(47)12617h35H12H3
METHYL3ISOTHIOCYANATO5(METHOXYCARBONYL)BENZOATE
MFCD06809670
ZINC000004343372
ZINC04343372
ZINC4343372
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