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53696-74-5

Name Armillarisin A
CAS 53696-74-5
EINECS(EC#) 215-749-0
Molecular Formula C12H10O5
MDL Number MFCD01662561
Molecular Weight 234.2
MOL File 53696-74-5.mol
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Chemical Properties

Melting point  250-255°C
Boiling point  565.0±50.0 °C(Predicted)
density  1.476±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
form  Solid
pka 7.10±0.20(Predicted)
color  Light yellow to green yellow
InChI InChI=1S/C12H10O5/c1-6(14)9-4-10-7(5-13)2-8(15)3-11(10)17-12(9)16/h2-4,13,15H,5H2,1H3
InChIKey XVZWWNMZVZWQKU-UHFFFAOYSA-N
SMILES C1(=O)OC2=CC(O)=CC(CO)=C2C=C1C(C)=O
CAS DataBase Reference 53696-74-5(CAS DataBase Reference)

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