123685-25-6

Name 2-bromo-3,4-dihydroxy-5-methoxybenzoic acid methyl ester
CAS 123685-25-6
Molecular Formula C9H9BrO5
MDL Number MFCD08059565
Molecular Weight 277.07
MOL File 123685-25-6.mol

Chemical Properties

Melting point  146 °C(Solv: ethanol (64-17-5))
Boiling point  391.0±37.0 °C(Predicted)
density  1.685±0.06 g/cm3(Predicted)
pka 7.07±0.20(Predicted)
InChI InChI=1S/C9H9BrO5/c1-14-5-3-4(9(13)15-2)6(10)8(12)7(5)11/h3,11-12H,1-2H3
InChIKey BKWQKJNQARMXHL-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC(OC)=C(O)C(O)=C1Br

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