2-(4-METHYLPHENYL)-3-OXOHEXANENITRILE

CAS No.
96514-78-2
CCD No.
CCD03487945
Formula
C13 H15 N O
MolWeight
201.268

Basic Information

Product Name: 2-(4-METHYLPHENYL)-3-OXOHEXANENITRILE
CAS: 96514-78-2
English Synonyms: 4-METHYL-A-(1-OXOBUTYL)-BENZENEACETONITRILE ; BENZENEACETONITRILE, 4-METHYL-A-(1-OXOBUTYL)- ; 2-(4-METHYLPHENYL)-3-OXOHEXANENITRILE
MDL Number.: MFCD17225841
H bond acceptor: 2
H bond donor: 0
Smile: CCCC(=O)C(C#N)c1ccc(cc1)C
InChi: InChI=1S/C13H15NO/c1-3-4-13(15)12(9-14)11-7-5-10(2)6-8-11/h5-8,12H,3-4H2,1-2H3
InChiKey: InChIKey=WGTZSMPDCNRZQY-UHFFFAOYSA-N

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