Vitas-M small molecule compound
4-(3,4-dimethoxyphenyl)-4-oxobutanenitrile
Catalog ID
STK694713
SMILES N#CCCC(=O)c1ccc(c(c1)OC)OC
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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 C12H13NO3 MW 219.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO3/c1-15-11-6-5-9(8-12(11)16-2)10(14)4-3-7-13/h5-6,8H,3-4H2,1-2H3InChIKey
VXADXTFGDCLVIC-UHFFFAOYSA-NSynonyms
70770-03-54(34dimethoxyphenyl)4oxobutanenitrile
70770035
BENZENEBUTANENITRILE34DIMETHOXYGAMMAOXO
COC1=C(C=C(C=C1)C(=O)CCC#N)OC
InChI=1SC12H13NO3c11511659(812(11)162)10(14)43713h568H34H212H3
MFCD10037684
ZINC000014988410
ZINC14988410
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