Vitas-M small molecule compound

2-(cyclooctylcarbamoyl)cyclohexanecarboxylic acid

Catalog ID
STK458479
SMILES O=C(C1CCCCC1C(=O)O)NC1CCCCCCC1

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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 C16H27NO3 MW 281.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27NO3/c18-15(13-10-6-7-11-14(13)16(19)20)17-12-8-4-2-1-3-5-9-12/h12-14H,1-11H2,(H,17,18)(H,19,20)
InChIKey
WWGAHHKLEGAQCW-UHFFFAOYSA-N
Synonyms

(1S2S)2(CYCLOOCTYLCARBAMOYL)CYCLOHEXANECARBOXYLICACID
2(CYCLOOCTYLCARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2(cyclooctylcarbamoyl)cyclohexanecarboxylicacid
2(NCYCLOOCTYLCARBAMOYL)CYCLOHEXANECARBOXYLICACID
C1CCCC(CCC1)NC(=O)C2CCCCC2C(=O)O
InChI=1SC16H27NO3c1815(1310671114(13)16(19)20)1712842135912h1214H111H2(H1718)(H1920)
MFCD01100773
ZINC000000475076
ZINC000002819373

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Available files

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