Vitas-M small molecule compound
3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile
Catalog ID
STL434893
SMILES COc1cc(cc(c1OC)OC)C(=O)CC#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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c1-15-10-6-8(9(14)4-5-13)7-11(16-2)12(10)17-3/h6-7H,4H2,1-3H3InChIKey
GFEMIDXDJDTTKQ-UHFFFAOYSA-NSynonyms
50606-35-4345TRIMETHOXYBENZOYLACETONITRILE
3oxo3(345trimethoxyphenyl)propanenitrile
50606354
BENZENEPROPANENITRILE345TRIMETHOXYBOXO
COC1=CC(=CC(=C1OC)OC)C(=O)CC#N
InChI=1SC12H13NO4c1151068(9(14)4513)711(162)12(10)173h67H4H213H3
MFCD02260785
ZINC000002579782
ZINC2579782
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