89919-62-0

Name (E,E)-3,5-Di-O-caffeoylquinic acid
CAS 89919-62-0
Molecular Formula C25H24O12
MDL Number MFCD23843780
Molecular Weight 516.46
MOL File 89919-62-0.mol
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Chemical Properties

Boiling point  826.2±65.0 °C(Predicted)
density  1.64
storage temp.  Sealed in dry,2-8°C
form  Solid
pka 3.52±0.50(Predicted)
color  White to off-white
InChIKey KRZBCHWVBQOTNZ-XLDUFQNVNA-N
SMILES O([C@@H]1C[C@@](O)(C(=O)O)C[C@@H](OC(=O)/C=C/C2C=CC(O)=C(O)C=2)[C@@H]1O)C(=O)/C=C/C1C=CC(O)=C(O)C=1 |&1:1,3,9,23,r|

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