Vitas-M small molecule compound

methyl 2-oxo-6-(phenylsulfanyl)hexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylate

Catalog ID
STK661391
SMILES COC(=O)C1C2CC3C1C(=O)OC3C2Sc1ccccc1

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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 C16H16O4S MW 304.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O4S/c1-19-15(17)12-10-7-9-11(12)16(18)20-13(9)14(10)21-8-5-3-2-4-6-8/h2-6,9-14H,7H2,1H3
InChIKey
RXCQJOLPGSZLQC-UHFFFAOYSA-N
Synonyms

COC(=O)C1C2CC3C1C(=O)OC3C2SC4=CC=CC=C4
InChI=1SC16H16O4Sc11915(17)12107911(12)16(18)2013(9)14(10)218532468h26914H7H21H3
methyl2oxo6(phenylsulfanyl)hexahydro2H35methanocyclopenta(b)furan7carboxylate
MFCD12130072
ZINC000102670284
ZINC000245242256

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Available files

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