131814-57-8
METHYL 2-((3-(2-FLUOROPHENYL)-4-OXO-4H-1-BENZOPYRAN-7-YL)OXY)PROPANOATE
NameMETHYL 2-((3-(2-FLUOROPHENYL)-4-OXO-4H-1-BENZOPYRAN-7-YL)OXY)PROPANOATE
1Identification
【Name】
METHYL 2-((3-(2-FLUOROPHENYL)-4-OXO-4H-1-BENZOPYRAN-7-YL)OXY)PROPANOATE
【CAS】
【MDL】
MFCD01697404
【English Synonyms】
【Formula】
C19 H15 F O5
【MolWeight】
342.32
【Inchi】
InChI=1S/C19H15FO5/c1-11(19(22)23-2)25-12-7-8-14-17(9-12)24-10-15(18(14)21)13-5-3-4-6-16(13)20/h3-11H,1-2H3
【InChIKey】
InChIKey=VAQYDTIMHYEPIJ-UHFFFAOYSA-N
【SMILES】
CC(C(=O)OC)Oc1ccc2c(c1)occ(c2=O)c3ccccc3F
【MOL File】
METHYL 2-((3-(2-FLUO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 2-((3-(2-FLUOROPHENYL)-4-OXO-4H-1-BENZOPYRAN-7-YL)OXY)PROPANOATE.cml