Vitas-M small molecule compound

3-methylbutyl 2-hydroxycyclohexanecarboxylate

Catalog ID
STL560843
SMILES CC(CCOC(=O)C1CCCCC1O)C

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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 C12H22O3 MW 214.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H22O3/c1-9(2)7-8-15-12(14)10-5-3-4-6-11(10)13/h9-11,13H,3-8H2,1-2H3
InChIKey
NEGXKXUAVASAAB-UHFFFAOYSA-N
Synonyms
7461-28-1
346651
3METHYLBUTYL2HYDROXYCYCLOHEXANE1CARBOXYLATE
3methylbutyl2hydroxycyclohexanecarboxylate
7461281
InChI=1SC12H22O3c19(2)781512(14)10534611(10)13h91113H38H212H3
isopentyl2hydroxycyclohexanecarboxylate
MFCD00482139
ZINC000000506679
ZINC000000506682

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Available files

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