Vitas-M small molecule compound

4-butoxy-3-chloro-5-ethoxybenzonitrile

Catalog ID
STK398127
SMILES CCCCOc1c(Cl)cc(cc1OCC)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 C13H16ClNO2 MW 253.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClNO2/c1-3-5-6-17-13-11(14)7-10(9-15)8-12(13)16-4-2/h7-8H,3-6H2,1-2H3
InChIKey
STWZMSUVYFITMJ-UHFFFAOYSA-N
Synonyms
445002-91-5
445002915
4BUTOXY3CHLORO5ETHOXYBENZENECARBONITRILE
4butoxy3chloro5ethoxybenzonitrile
CCCCOC1=C(C=C(C=C1Cl)C#N)OCC
InChI=1SC13H16ClNO2c1356171311(14)710(915)812(13)1642h78H36H212H3
MFCD02256422
ZINC000002764624
ZINC02764624
ZINC2764624

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Available files

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