Vitas-M small molecule compound

2-(2-cyclopropyl-2-oxoethoxy)-5-methoxybenzonitrile

Catalog ID
STK546468
SMILES N#Cc1cc(OC)ccc1OCC(=O)C1CC1

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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 C13H13NO3 MW 231.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO3/c1-16-11-4-5-13(10(6-11)7-14)17-8-12(15)9-2-3-9/h4-6,9H,2-3,8H2,1H3
InChIKey
BYVDOBZIPLWBEZ-UHFFFAOYSA-N
Synonyms
796881-19-1
2(2cyclopropyl2oxoethoxy)5methoxybenzonitrile
796881191
COC1=CC(=C(C=C1)OCC(=O)C2CC2)C#N
InChI=1SC13H13NO3c116114513(10(611)714)17812(15)9239h469H238H21H3
MFCD02855154
ZINC000000552744
ZINC00552744
ZINC552744

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.