Vitas-M small molecule compound

6-(cyclopropylmethyl)-7-nitro-2,3-dihydro-1,4-benzodioxine

Catalog ID
STK026391
SMILES [O-][N+](=O)c1cc2OCCOc2cc1CC1CC1

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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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c14-13(15)10-7-12-11(16-3-4-17-12)6-9(10)5-8-1-2-8/h6-8H,1-5H2
InChIKey
LMMWLAGBPVCKCX-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc2OCCOc2cc1CC1CC1
6(CYCLOPROPYLMETHYL)7NITRO23DIHYDRO14BENZODIOXINE
6CYCLOPROPYLMETHYL7NITRO23DIHYDROBENZO(14)DIOXINE
7(CYCLOPROPYLMETHYL)6NITRO23DIHYDRO14BENZODIOXINE
7(CYCLOPROPYLMETHYL)6NITRO2H3HBENZO(E)14DIOXANE
C1CC1CC2=CC3=C(C=C2(N+)(=O)(O))OCCO3
InChI=1SC12H13NO4c1413(15)1071211(16341712)69(10)58128h68H15H2
MFCD00561861
STK026391
ZINC000000032518
ZINC00032518
ZINC32518

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Available files

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