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131-12-4

Name pimpinellin
CAS 131-12-4
Molecular Formula C13H10O5
MDL Number MFCD00597237
Molecular Weight 246.22
MOL File 131-12-4.mol
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Chemical Properties

Melting point  119°
Boiling point  441.0±45.0 °C(Predicted)
density  1.352±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
form  powder
color  Yellow
InChI InChI=1S/C13H10O5/c1-15-11-7-3-4-9(14)18-10(7)8-5-6-17-12(8)13(11)16-2/h3-6H,1-2H3
InChIKey BQPRWZCEKZLBHL-UHFFFAOYSA-N
SMILES C1(=O)OC2C3C=COC=3C(OC)=C(OC)C=2C=C1
LogP 1.477 (est)

Safety Data

Hazardous Substances Data 131-12-4(Hazardous Substances Data)

Hazard Information

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