159934-11-9

Name PalMaruMycin C3
CAS 159934-11-9
Molecular Formula C20H12O6
Molecular Weight 348.31
MOL File 159934-11-9.mol
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Chemical Properties

Boiling point  715.2±60.0 °C(Predicted)
density  1.71±0.1 g/cm3(Predicted)
storage temp.  -20°C
form  A solid
pka 8.18±0.20(Predicted)
color  Yellow to green
InChI InChI=1S/C20H12O6/c21-10-7-8-11(22)16-15(10)17(23)18-19(24-18)20(16)25-12-5-1-3-9-4-2-6-13(26-20)14(9)12/h1-8,18-19,21-22H/t18-,19-/m1/s1
InChIKey BDXBHYOFNNANPN-RTBURBONSA-N
SMILES O1[C@]2([H])C(=O)C3=C(C4(OC5=CC=CC6=C5C(=CC=C6)O4)[C@]12[H])C(O)=CC=C3O

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)Exclamation Mark (GHS07)
GHS06,GHS07
Signal word  Danger

Hazard Information

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