Vitas-M small molecule compound

3-[(4-chloro-2-hydroxyphenyl)amino]-5,5-dimethylcyclohex-2-en-1-one

Catalog ID
STL357486
SMILES O=C1C=C(Nc2ccc(cc2O)Cl)CC(C1)(C)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 C14H16ClNO2 MW 265.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16ClNO2/c1-14(2)7-10(6-11(17)8-14)16-12-4-3-9(15)5-13(12)18/h3-6,16,18H,7-8H2,1-2H3
InChIKey
UXNVCNSIAJEURG-UHFFFAOYSA-N
Synonyms
371200-57-6
3((4chloro2hydroxyphenyl)amino)55dimethylcyclohex2en1one
3((4chloro2hydroxyphenyl)amino)55dimethylcyclohex2enone
3(4CHLORO2HYDROXYANILINO)55DIMETHYLCYCLOHEX2EN1ONE
371200576
CC1(CC(=CC(=O)C1)NC2=C(C=C(C=C2)Cl)O)C
InChI=1SC14H16ClNO2c114(2)710(611(17)814)1612439(15)513(12)18h361618H78H212H3
MFCD00297541
ZINC000000290943
ZINC00290943
ZINC290943

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Available files

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