Vitas-M small molecule compound

4,5-dibromo-3-methylcyclohexane-1,2-dicarboxylic acid

Catalog ID
STK858613
SMILES BrC1CC(C(=O)O)C(C(C1Br)C)C(=O)O

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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 C9H12Br2O4 MW 344.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12Br2O4/c1-3-6(9(14)15)4(8(12)13)2-5(10)7(3)11/h3-7H,2H2,1H3,(H,12,13)(H,14,15)
InChIKey
ZLBZDHSWWOYOSK-UHFFFAOYSA-N
Synonyms
65941-85-7
45dibromo3methylcyclohexane12dicarboxylicacid
65941857
CC1C(C(CC(C1Br)Br)C(=O)O)C(=O)O
InChI=1SC9H12Br2O4c136(9(14)15)4(8(12)13)25(10)7(3)11h37H2H21H3(H1213)(H1415)
MFCD12197722
ZINC000101193951
ZINC000242750310

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Available files

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