898754-46-6
4'-CYANO-3-(2,6-DIMETHYLPHENYL)PROPIOPHENONE
Name4'-CYANO-3-(2,6-DIMETHYLPHENYL)PROPIOPHENONE
1Identification
【Name】
4'-CYANO-3-(2,6-DIMETHYLPHENYL)PROPIOPHENONE
【CAS】
【MDL】
MFCD03843772
【English Synonyms】
【Formula】
C18 H17 N O
【MolWeight】
263.338
【Inchi】
InChI=1S/C18H17NO/c1-13-4-3-5-14(2)17(13)10-11-18(20)16-8-6-15(12-19)7-9-16/h3-9H,10-11H2,1-2H3
【InChIKey】
InChIKey=QYAKRKHAEYTLKP-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1CCC(=O)c2ccc(cc2)C#N)C
【MOL File】
4'-CYANO-3-(2,6-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4'-CYANO-3-(2,6-DIMETHYLPHENYL)PROPIOPHENONE.cml