Vitas-M small molecule compound
methyl 3-cyano-3-(4,5-dimethoxy-2-nitrophenyl)propanoate
Catalog ID
STK665895
SMILES COC(=O)CC(c1cc(OC)c(cc1[N+](=O)[O-])OC)C#N
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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 C13H14N2O6 MW 294.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O6/c1-19-11-5-9(8(7-14)4-13(16)21-3)10(15(17)18)6-12(11)20-2/h5-6,8H,4H2,1-3H3InChIKey
HRWRBHWBIXXULQ-UHFFFAOYSA-NSynonyms
COC(=O)CC(c1cc(OC)c(cc1(N+)(=O)(O))OC)C#N
COC1=C(C=C(C(=C1)C(CC(=O)OC)C#N)(N+)(=O)(O))OC
InChI=1SC13H14N2O6c1191159(8(714)413(16)213)10(15(17)18)612(11)202h568H4H213H3
METHYL3(45DIMETHOXY2NITROPHENYL)3CYANOPROPANOATE
methyl3cyano3(45dimethoxy2nitrophenyl)propanoate
MFCD12034072
ZINC000015109059
ZINC000015109062
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.