Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-3-nitro-1H-1,2,4-triazole
Catalog ID
STK773273
SMILES [O-][N+](=O)c1ncn(n1)Cc1ccc2c(c1)OCO2
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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 C10H8N4O4 MW 248.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8N4O4/c15-14(16)10-11-5-13(12-10)4-7-1-2-8-9(3-7)18-6-17-8/h1-3,5H,4,6H2InChIKey
ACSFDWNTGAJADG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ncn(n1)Cc1ccc2c(c1)OCO2
1(13BENZODIOXOL5YLMETHYL)3NITRO124TRIAZOLE
1(13benzodioxol5ylmethyl)3nitro1H124triazole
5((3NITRO124TRIAZOLYL)METHYL)2HBENZO(D)13DIOXOLANE
C1OC2=C(O1)C=C(C=C2)CN3C=NC(=N3)(N+)(=O)(O)
InChI=1SC10H8N4O4c1514(16)1011513(1210)471289(37)186178h135H46H2
MFCD03821539
ZINC000000109447
ZINC00109447
ZINC109447
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