Vitas-M small molecule compound

2-tert-butyl-2-methyl-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-dioxane-4,6-dione

Catalog ID
STK868792
SMILES CC(C1(C)OC(=O)/C(=C/c2cc3OCOc3cc2[N+](=O)[O-])/C(=O)O1)(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 C17H17NO8 MW 363.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO8/c1-16(2,3)17(4)25-14(19)10(15(20)26-17)5-9-6-12-13(24-8-23-12)7-11(9)18(21)22/h5-7H,8H2,1-4H3/b10-5-
InChIKey
RXAPYLGZVSCQIB-YHYXMXQVSA-N
Synonyms
425630-70-2
2(tertbutyl)2methyl5((6nitrobenzo(d)(13)dioxol5yl)methylene)13dioxane46dione
2tertbutyl2methyl5((6nitro13benzodioxol5yl)methylidene)13dioxane46dione
425630702
CC(C1(C)OC(=O)C(=Cc2cc3OCOc3cc2(N+)(=O)(O))C(=O)O1)(C)C
MFCD02636638
ZINC000001182343

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Available files

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