Vitas-M small molecule compound

1-(1-hydroxycyclohexyl)-3-(4-methoxyphenyl)propan-1-one

Catalog ID
STK758641
SMILES COc1ccc(cc1)CCC(=O)C1(O)CCCCC1

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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 C16H22O3 MW 262.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22O3/c1-19-14-8-5-13(6-9-14)7-10-15(17)16(18)11-3-2-4-12-16/h5-6,8-9,18H,2-4,7,10-12H2,1H3
InChIKey
WKBCGFKBGIWXAW-UHFFFAOYSA-N
Synonyms
312318-69-7
1(1hydroxycyclohexyl)3(4methoxyphenyl)propan1one
1(HYDROXYCYCLOHEXYL)3(4METHOXYPHENYL)PROPAN1ONE
312318697
COC1=CC=C(C=C1)CCC(=O)C2(CCCCC2)O
InChI=1SC16H22O3c119148513(6914)71015(17)16(18)113241216h568918H2471012H21H3
MFCD00764053
ZINC000000069955
ZINC00069955
ZINC69955

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Available files

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