891784-17-1
2-PENTANONE, 4-(4-FLUOROPHENYL)-
Name2-PENTANONE, 4-(4-FLUOROPHENYL)-
1Identification
【Name】
2-PENTANONE, 4-(4-FLUOROPHENYL)-
【CAS】
【MDL】
MFCD09891036
【English Synonyms】
【Formula】
C11 H13 F O
【MolWeight】
180.221
【Inchi】
InChI=1S/C11H13FO/c1-8(7-9(2)13)10-3-5-11(12)6-4-10/h3-6,8H,7H2,1-2H3
【InChIKey】
InChIKey=MTSHJEYVEWYMMO-UHFFFAOYSA-N
【SMILES】
CC(CC(=O)C)c1ccc(cc1)F
【MOL File】
2-PENTANONE, 4-(4-FL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-PENTANONE, 4-(4-FLUOROPHENYL)-.cml