2-(4-CHLOROPHENYL)-5-METHYL-3-OXOHEXANENITRILE

CAS No.
855910-41-7
CCD No.
CCD01113193
Formula
C13 H14 Cl N O
MolWeight
235.713

Basic Information

Product Name: 2-(4-CHLOROPHENYL)-5-METHYL-3-OXOHEXANENITRILE
CAS: 855910-41-7
English Synonyms: 4-CHLORO-A-(3-METHYL-1-OXOBUTYL)-BENZENEACETONITRILE ; BENZENEACETONITRILE, 4-CHLORO-A-(3-METHYL-1-OXOBUTYL)- ; 2-(4-CHLOROPHENYL)-5-METHYL-3-OXOHEXANENITRILE
MDL Number.: MFCD11208640
H bond acceptor: 2
H bond donor: 0
Smile: CC(C)CC(=O)C(C#N)c1ccc(cc1)Cl
InChi: InChI=1S/C13H14ClNO/c1-9(2)7-13(16)12(8-15)10-3-5-11(14)6-4-10/h3-6,9,12H,7H2,1-2H3
InChiKey: InChIKey=OPWOQSSEBMQHJM-UHFFFAOYSA-N

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