Vitas-M small molecule compound

5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-methyl-4-nitro-1,2-oxazole

Catalog ID
STK862980
SMILES [O-][N+](=O)c1c(/C=C/c2ccc3c(c2)OCO3)onc1C

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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 C13H10N2O5 MW 274.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N2O5/c1-8-13(15(16)17)11(20-14-8)5-3-9-2-4-10-12(6-9)19-7-18-10/h2-6H,7H2,1H3/b5-3+
InChIKey
BWHVGLMZYWXPBW-HWKANZROSA-N
Synonyms
51978-99-5
(E)5(2(benzo(d)(13)dioxol5yl)vinyl)3methyl4nitroisoxazole
(O)(N+)(=O)c1c(C=Cc2ccc3c(c2)OCO3)onc1C
3METHYL4NITRO5(2(13BENZODIOXOLE5YL)ETHENYL)ISOXAZOLE
5((E)2(13benzodioxol5yl)ethenyl)3methyl4nitro12oxazole
51978995
CC1=NOC(=C1(N+)(=O)(O))C=CC2=CC3=C(C=C2)OCO3
InChI=1SC13H10N2O5c1813(15(16)17)11(20148)539241012(69)1971810h26H7H21H3b53+
MFCD03235150
ZINC000001004478
ZINC01004478
ZINC1004478

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Available files

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