919475-62-0
1(3H)-ISOBENZOFURANONE, 3-(3-FLUOROPHENYL)-3-HYDROXY-5-METHOXY-
Name1(3H)-ISOBENZOFURANONE, 3-(3-FLUOROPHENYL)-3-HYDROXY-5-METHOXY-
1Identification
【Name】
1(3H)-ISOBENZOFURANONE, 3-(3-FLUOROPHENYL)-3-HYDROXY-5-METHOXY-
【CAS】
【MDL】
MFCD13191866
【English Synonyms】
【Formula】
C15 H11 F O4
【MolWeight】
274.246
【Inchi】
InChI=1S/C15H11FO4/c1-19-11-5-6-12-13(8-11)15(18,20-14(12)17)9-3-2-4-10(16)7-9/h2-8,18H,1H3
【InChIKey】
InChIKey=QVHJWCDEUNZUQM-UHFFFAOYSA-N
【SMILES】
COc1ccc2c(c1)C(OC2=O)(c3cccc(c3)F)O
【MOL File】
1(3H)-ISOBENZOFURANO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1(3H)-ISOBENZOFURANONE, 3-(3-FLUOROPHENYL)-3-HYDROXY-5-METHOXY-.cml