59204-70-5
1,3,4,5,6-PENTAHYDROXY-2-METHYL-9,10-ANTHRAQUINONE
Name1,3,4,5,6-PENTAHYDROXY-2-METHYL-9,10-ANTHRAQUINONE
1Identification
【Name】
1,3,4,5,6-PENTAHYDROXY-2-METHYL-9,10-ANTHRAQUINONE
【CAS】
【MDL】
MFCD18974894
【English Synonyms】
【Formula】
C15 H10 O7
【MolWeight】
302.237
【Inchi】
InChI=1S/C15H10O7/c1-4-10(17)8-9(15(22)11(4)18)14(21)7-5(12(8)19)2-3-6(16)13(7)20/h2-3,16-18,20,22H,1H3
【InChIKey】
InChIKey=OVQCZXSFJXZFJF-UHFFFAOYSA-N
【SMILES】
Cc1c(c2c(c(c1O)O)C(=O)c3c(ccc(c3O)O)C2=O)O
【MOL File】
1,3,4,5,6-PENTAHYDRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,3,4,5,6-PENTAHYDROXY-2-METHYL-9,10-ANTHRAQUINONE.cml