Vitas-M small molecule compound

2-(azepan-1-ylcarbonyl)-5-methoxy-4H-pyran-4-one

Catalog ID
STL423713
SMILES COc1coc(cc1=O)C(=O)N1CCCCCC1

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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 C13H17NO4 MW 251.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO4/c1-17-12-9-18-11(8-10(12)15)13(16)14-6-4-2-3-5-7-14/h8-9H,2-7H2,1H3
InChIKey
PDAVZTFXHNRVSV-UHFFFAOYSA-N
Synonyms
1105220-43-6
1105220436
2(azepan1ylcarbonyl)5methoxy4Hpyran4one
2(AZEPANE1CARBONYL)5METHOXY4HPYRAN4ONE
2(azepane1carbonyl)5methoxypyran4one
COC1=COC(=CC1=O)C(=O)N2CCCCCC2
InChI=1SC13H17NO4c1171291811(810(12)15)13(16)1464235714h89H27H21H3
MFCD12010594
ZINC000023136899
ZINC23136899

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Available files

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