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23725-05-5

Name Chebulic Acid
CAS 23725-05-5
Molecular Formula C14H12O11
MDL Number MFCD09264641
Molecular Weight 356.24
MOL File 23725-05-5.mol
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Chemical Properties

Boiling point  755.9±60.0 °C(Predicted)
density  1.882
solubility  Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
form  Powder
pka 2.60±0.40(Predicted)
color  White to off-white
InChI InChI=1S/C14H12O11/c15-5-1-4-7(10(19)9(5)18)8(3(12(20)21)2-6(16)17)11(13(22)23)25-14(4)24/h1,3,8,11,15,18-19H,2H2,(H,16,17)(H,20,21)(H,22,23)/t3-,8-,11-/m0/s1
InChIKey COZMWVAACFYLBI-XJEVXTIOSA-N
SMILES C(O)(=O)[C@H]([C@H]1C2=C(O)C(O)=C(O)C=C2C(=O)O[C@@H]1C(O)=O)CC(O)=O

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