Vitas-M small molecule compound

3-(4-chlorophenyl)-3-oxopropanenitrile

Catalog ID
STK500553
SMILES N#CCC(=O)c1ccc(cc1)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 C9H6ClNO MW 179.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6ClNO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5H2
InChIKey
JYOUFPNYTOFCSJ-UHFFFAOYSA-N
Synonyms
4640-66-8
(4CHLOROBENZOYL)ACETONITRILE
3(4chlorophenyl)3oxopropanenitrile
3(4CHLOROPHENYL)3OXOPROPIONITRILE
4640668
4CHLORO2CYANOACETOPHENONE
4CHLOROBENZOYLACETONITIRLE
4CHLOROBENZOYLACETONITRILE
4CHLOROBENZOYLACETONITRILE3(4CHLOROPHENYL)3OXOPROPANENITRILE
4CHLOROPHENACYLCYANIDE
BENZENEPROPANENITRILE4CHLOROAOXO
BENZENEPROPANENITRILE4CHLOROBETAOXO
C1=CC(=CC=C1C(=O)CC#N)Cl
InChI=1SC9H6ClNOc108317(248)9(12)5611h14H5H2
MFCD00051625
PCHLOROPHENACYLCYANIDE
ZINC000000095250
ZINC00095250
ZINC95250

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Available files

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