Vitas-M small molecule compound

3-chloro-4,5-dimethoxybenzonitrile

Catalog ID
STK397521
SMILES COc1cc(C#N)cc(c1OC)Cl

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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 C9H8ClNO2 MW 197.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8ClNO2/c1-12-8-4-6(5-11)3-7(10)9(8)13-2/h3-4H,1-2H3
InChIKey
FYVNQNKFUPQFLQ-UHFFFAOYSA-N
Synonyms
90537-30-7
3CHLORO45DIMETHOXYBENZENECARBONITRILE
3chloro45dimethoxybenzonitrile
90537307
BENZONITRILE3CHLORO45DIMETHOXY
COC1=C(C(=CC(=C1)C#N)Cl)OC
InChI=1SC9H8ClNO2c112846(511)37(10)9(8)132h34H12H3
MFCD02256340
ZINC000000365888
ZINC00365888
ZINC365888

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Available files

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