Vitas-M small molecule compound

3-[(cyclohexylamino)methyl]-4-methoxybenzoic acid

Catalog ID
STK893531
SMILES COc1ccc(cc1CNC1CCCCC1)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 C15H21NO3 MW 263.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO3/c1-19-14-8-7-11(15(17)18)9-12(14)10-16-13-5-3-2-4-6-13/h7-9,13,16H,2-6,10H2,1H3,(H,17,18)
InChIKey
MTBLFTQWXGNJRU-UHFFFAOYSA-N
Synonyms
881041-14-1
3((cyclohexylamino)methyl)4methoxybenzoicacid
3((CYCLOHEXYLAZANIUMYL)METHYL)4METHOXYBENZOATE
881041141
COC1=C(C=C(C=C1)C(=O)(O))C(NH2+)C2CCCCC2
InChI=1SC15H21NO3c119148711(15(17)18)912(14)1016135324613h791316H2610H21H3(H1718)
MFCD06653198
ZINC000004237616
ZINC04237616
ZINC4237616

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Available files

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