Vitas-M small molecule compound

2-[2-(2-hydroxy-5-nitrophenyl)hydrazinylidene]-5,5-dimethylcyclohexane-1,3-dione

Catalog ID
STK044086
SMILES O=C1CC(C)(C)CC(=O)C1=NNc1cc(ccc1O)[N+](=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 C14H15N3O5 MW 305.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O5/c1-14(2)6-11(19)13(12(20)7-14)16-15-9-5-8(17(21)22)3-4-10(9)18/h3-5,15,18H,6-7H2,1-2H3
InChIKey
LNFYUTXLEHCJFB-UHFFFAOYSA-N
Synonyms

2((2HYDROXY5NITROPHENYL)HYDRAZINYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
2(2(2HYDROXY5NITROPHENYL)HYDRAZINYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
55DIMETHYLCYCLOHEXANE123TRIONE2((2HYDROXY5NITROPHENYL)HYDRAZONE)
CC1(CC(=O)C(=NNC2=C(C=CC(=C2)(N+)(=O)(O))O)C(=O)C1)C
InChI=1SC14H15N3O5c114(2)611(19)13(12(20)714)1615958(17(21)22)3410(9)18h351518H67H212H3
MFCD02025422
O=C1CC(C)(C)CC(=O)C1=NNc1cc(ccc1O)(N+)(=O)(O)
STK044086
ZINC000035973926
ZINC35973926

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Available files

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