Vitas-M small molecule compound

2,2-dimethyl-5-nitro-1,3-benzodioxole

Catalog ID
STL356767
SMILES [O-][N+](=O)c1ccc2c(c1)OC(O2)(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 C9H9NO4 MW 195.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO4/c1-9(2)13-7-4-3-6(10(11)12)5-8(7)14-9/h3-5H,1-2H3
InChIKey
XCEHELWIDYNWCU-UHFFFAOYSA-N
Synonyms
54186-68-4
(O)(N+)(=O)c1ccc2c(c1)OC(O2)(C)C
22dimethyl5nitro13benzodioxole
22DIMETHYL5NITRO2H13BENZODIOXOLE
22DIMETHYL5NITROBENZO(13)DIOXOLE
22DIMETHYL5NITROBENZO(D)(13)DIOXOLE
22DIMETHYL5NITROBENZO(D)13DIOXOLENE
54186684
CC1(OC2=C(O1)C=C(C=C2)(N+)(=O)(O))C
InChI=1SC9H9NO4c19(2)137436(10(11)12)58(7)149h35H12H3
MFCD01463447
ZINC000000122555
ZINC00122555
ZINC122555

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Available files

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