887574-90-5
1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE
Name1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE
1Identification
【Name】
1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE
【CAS】
【MDL】
MFCD06657013
【English Synonyms】
【Formula】
C17 H18 O2
【MolWeight】
254.327
【Inchi】
InChI=1S/C17H18O2/c1-12(2)15-5-4-6-17(11-15)19-16-9-7-14(8-10-16)13(3)18/h4-12H,1-3H3
【InChIKey】
InChIKey=VXQRINFVRMXODA-UHFFFAOYSA-N
【SMILES】
CC(C)c1cccc(c1)Oc2ccc(cc2)C(=O)C
【MOL File】
1-[4-(3-ISOPROPYL-PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE.cml