Vitas-M small molecule compound
(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)methyl pyridin-4-ylcarbamate
Catalog ID
STK129956
SMILES O=C(Nc1ccncc1)OCC1(COC(OC1)(C)C)[N+](=O)[O-]
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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 C13H17N3O6 MW 311.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O6/c1-12(2)21-8-13(9-22-12,16(18)19)7-20-11(17)15-10-3-5-14-6-4-10/h3-6H,7-9H2,1-2H3,(H,14,15,17)InChIKey
BNFJMYLENQLROP-UHFFFAOYSA-NSynonyms
(22DIMETHYL5NITRO13DIOXAN5YL)METHYLNPYRIDIN4YLCARBAMATE(22DIMETHYL5NITRO13DIOXAN5YL)METHYLPYRIDIN4YLCARBAMATE
CC1(OCC(CO1)(COC(=O)NC2=CC=NC=C2)(N+)(=O)(O))C
O=C(Nc1ccncc1)OCC1(COC(OC1)(C)C)(N+)(=O)(O)
Registry IDs
MFCD00713811ZINC000002550504
ZINC02550504
ZINC2550504
Check stock
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Check stock on Vitas-MAvailable files
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