Vitas-M small molecule compound

1-(2-ethyl-2-methyltetrahydro-2H-thiopyran-4-yl)pentan-1-one

Catalog ID
STL323969
SMILES CCCCC(=O)C1CCSC(C1)(C)CC

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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 C13H24OS MW 228.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H24OS/c1-4-6-7-12(14)11-8-9-15-13(3,5-2)10-11/h11H,4-10H2,1-3H3
InChIKey
DWJUDPYNGIAEQK-UHFFFAOYSA-N
Synonyms
86252-02-0
1((2R4R)2ETHYL2METHYLTETRAHYDRO2HTHIOPYRAN4YL)PENTAN1ONE
1((2S4R)2ETHYL2METHYLTETRAHYDRO2HTHIOPYRAN4YL)PENTAN1ONE
1((2S4S)2ETHYL2METHYLTETRAHYDRO2HTHIOPYRAN4YL)PENTAN1ONE
1(2ethyl2methyltetrahydro2Hthiopyran4yl)pentan1one
1(2ETHYL2METHYLTETRAHYDROTHIOPYRAN4YL)PENTAN1ONE
1(2ETHYL2METHYLTHIAN4YL)PENTAN1ONE
86252020
InChI=1SC13H24OSc146712(14)11891513(352)1011h11H410H213H3
MFCD01540572
ZINC000002372340
ZINC000002372345

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Available files

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