521-65-3
1,8-DIHYDROXY-3,5-DIMETHOXY-9H-XANTHEN-9-ONE
Name1,8-DIHYDROXY-3,5-DIMETHOXY-9H-XANTHEN-9-ONE
1Identification
【Name】
1,8-DIHYDROXY-3,5-DIMETHOXY-9H-XANTHEN-9-ONE
【CAS】
【MDL】
MFCD01741510
【English Synonyms】
【Formula】
C15 H12 O6
【MolWeight】
288.254
【Inchi】
InChI=1S/C15H12O6/c1-19-7-5-9(17)12-11(6-7)21-15-10(20-2)4-3-8(16)13(15)14(12)18/h3-6,16-17H,1-2H3
【InChIKey】
InChIKey=GNSHHHWDGOHNPC-UHFFFAOYSA-N
【SMILES】
COc1ccc(c2c1oc3cc(cc(c3c2=O)O)OC)O
【MOL File】
1,8-DIHYDROXY-3,5-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,8-DIHYDROXY-3,5-DIMETHOXY-9H-XANTHEN-9-ONE.cml