690682-01-0
[(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETIC ACID
Name[(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETIC ACID
1Identification
【Name】
[(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETIC ACID
【CAS】
【MDL】
MFCD03713118
【English Synonyms】
【Formula】
C13 H11 Cl O5
【MolWeight】
282.678
【Inchi】
InChI=1S/C13H11ClO5/c1-2-7-3-13(17)19-10-5-11(18-6-12(15)16)9(14)4-8(7)10/h3-5H,2,6H2,1H3,(H,15,16)
【InChIKey】
InChIKey=LQKYZSYRLWUYET-UHFFFAOYSA-N
【SMILES】
CCc1cc(=O)oc2c1cc(c(c2)OCC(=O)O)Cl
【MOL File】
[(6-CHLORO-4-ETHYL-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YL)OXY]ACETIC ACID.cml