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484-76-4
OKANIN
Name
OKANIN
Formula
C15 H12 O6
MolWeight
288.254
1Identification
【Name】
OKANIN
【CAS】
【MDL】
MFCD00017392
【English Synonyms】
【Formula】
C15 H12 O6
【MolWeight】
288.254
【Inchi】
InChI=1S/C15H12O6/c16-10(9-3-6-12(18)15(21)14(9)20)4-1-8-2-5-11(17)13(19)7-8/h1-7,17-21H/b4-1+
【InChIKey】
InChIKey=GSBNFGRTUCCBTK-DAFODLJHSA-N
【SMILES】
c1cc(c(cc1/C=C/C(=O)c2ccc(c(c2O)O)O)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:5
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
OKANIN.cml
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