500002-93-7
1-(4-FLUORO-3-HYDROXY-2,5-CYCLOHEXADIEN-1-YL)-ETHANONE
Name1-(4-FLUORO-3-HYDROXY-2,5-CYCLOHEXADIEN-1-YL)-ETHANONE
1Identification
【Name】
1-(4-FLUORO-3-HYDROXY-2,5-CYCLOHEXADIEN-1-YL)-ETHANONE
【CAS】
【MDL】
MFCD18829553
【English Synonyms】
【Formula】
C8 H9 F O2
【MolWeight】
156.155
【Inchi】
InChI=1S/C8H9FO2/c1-5(10)6-2-3-7(9)8(11)4-6/h2-4,6-7,11H,1H3
【InChIKey】
InChIKey=ZKCBDSPRXFFKMJ-UHFFFAOYSA-N
【SMILES】
CC(=O)C1C=CC(C(=C1)O)F
【MOL File】
1-(4-FLUORO-3-HYDROX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-FLUORO-3-HYDROXY-2,5-CYCLOHEXADIEN-1-YL)-ETHANONE.cml