21422-04-8

Name 7-demethylsuberosin
CAS 21422-04-8
Molecular Formula C14H14O3
MDL Number MFCD21496371
Molecular Weight 230.26
MOL File 21422-04-8.mol
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Chemical Properties

Melting point  134-136℃
Boiling point  418.8±45.0 °C(Predicted)
density  1.203±0.06 g/cm3(Predicted)
solubility  DMSO: 250 mg/ml
form  A solid
pka 8.45±0.20(Predicted)
color  White to off-white
InChI InChI=1S/C14H14O3/c1-9(2)3-4-10-7-11-5-6-14(16)17-13(11)8-12(10)15/h3,5-8,15H,4H2,1-2H3
InChIKey FIDUIAPDSKSUGO-UHFFFAOYSA-N
SMILES C1(=O)OC2=CC(O)=C(C/C=C(/C)\C)C=C2C=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Hazard Information

Spectrum Detail

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