Vitas-M small molecule compound

methyl 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxylate

Catalog ID
STK965321
SMILES COC(=O)C12CCC(C2(C)C)(C(=O)C1)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 C12H18O3 MW 210.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18O3/c1-10(2)11(3)5-6-12(10,7-8(11)13)9(14)15-4/h5-7H2,1-4H3
InChIKey
ZEGAXTLRYKZARX-UHFFFAOYSA-N
Synonyms
62123-03-9
(1R4R)methyl477trimethyl3oxobicyclo(221)heptane1carboxylate
62123039
BICYCLO(221)HEPTANE1CARBOXYLICACID477TRIMETHYL3OXOMETHYLESTER
CC1(C2(CCC1(CC2=O)C(=O)OC)C)C
InChI=1SC12H18O3c110(2)11(3)5612(1078(11)13)9(14)154h57H214H3
METHYL177TRIMETHYL2OXOBICYCLO(221)HEPTANE4CARBOXYLATE
METHYL477TRIMETHYL3OXOBICYCLO(221)HEPTANE1CARBOXYLATE
MFCD03731222
ZINC000000467359

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Available files

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