224040-82-8
1-(3,4-DIMETHYLPHENYL)-2-(4-PYRIDINYL)-ETHANONE
Name1-(3,4-DIMETHYLPHENYL)-2-(4-PYRIDINYL)-ETHANONE
1Identification
【Name】
1-(3,4-DIMETHYLPHENYL)-2-(4-PYRIDINYL)-ETHANONE
【CAS】
【MDL】
MFCD17093120
【English Synonyms】
【Formula】
C15 H15 N O
【MolWeight】
225.29
【Inchi】
InChI=1S/C15H15NO/c1-11-3-4-14(9-12(11)2)15(17)10-13-5-7-16-8-6-13/h3-9H,10H2,1-2H3
【InChIKey】
InChIKey=KXMOHFBIDQICAP-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1C)C(=O)Cc2ccncc2
【MOL File】
1-(3,4-DIMETHYLPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3,4-DIMETHYLPHENYL)-2-(4-PYRIDINYL)-ETHANONE.cml