Identification Chemical Properties Hazard Information Supplier

6121-77-3

Name Benzoic acid, 2-heptyl-4,6-dihydroxy-, methyl ester
CAS 6121-77-3
Molecular Formula C15H22O4
Molecular Weight 266.33
MOL File 6121-77-3.mol

Chemical Properties

Boiling point  431.8±30.0 °C(Predicted)
density  1.111±0.06 g/cm3(Predicted)
pka 8.28±0.23(Predicted)
InChI InChI=1S/C15H22O4/c1-3-4-5-6-7-8-11-9-12(16)10-13(17)14(11)15(18)19-2/h9-10,16-17H,3-8H2,1-2H3
InChIKey UXZJWFSSCUTTBN-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=C(O)C=C(O)C=C1CCCCCCC

Hazard Information

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