Vitas-M small molecule compound

3-(2-bromophenyl)-3-oxopropanenitrile

Catalog ID
STK662212
SMILES N#CCC(=O)c1ccccc1Br

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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 C9H6BrNO MW 224.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6BrNO/c10-8-4-2-1-3-7(8)9(12)5-6-11/h1-4H,5H2
InChIKey
KETIGQNBJUHYCA-UHFFFAOYSA-N
Synonyms
53882-80-7
2BROMOBENZOYLACETONITRILE
3(2bromophenyl)3oxopropanenitrile
3(2BROMOPHENYL)3OXOPROPANITRILE
3(2BROMOPHENYL)3OXOPROPIONITRILE
3OXO3(2BROMOPHENYL)PROPIONONITRILE
53882807
BENZENEPROPANENITRILE2BROMOBETAOXO
BENZENEPROPANENITRILE2BROMOBOXO
C1=CC=C(C(=C1)C(=O)CC#N)Br
InChI=1SC9H6BrNOc10842137(8)9(12)5611h14H5H2
MFCD02260798
OBROMOPHENACYLCYANIDE
ZINC000002579795
ZINC02579795
ZINC2579795

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Available files

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