CAS | 41137-86-4 |
Synonyms | 3-Heptanone, 1,7-bis(3,4-dihydroxyphenyl)-5-hydroxy-, (5S)- |
IUPAC Name | (5S)-1,7-bis(3,4-dihydroxyphenyl)-5-hydroxyheptan-3-one |
Molecular Weight | 346.37 |
Molecular Formula | C19H22O6 |
Canonical SMILES | C1=CC(=C(C=C1CC[C@@H](CC(=O)CCC2=CC(=C(C=C2)O)O)O)O)O |
InChI | InChI=1S/C19H22O6/c20-14(5-1-12-3-7-16(22)18(24)9-12)11-15(21)6-2-13-4-8-17(23)19(25)10-13/h3-4,7-10,14,20,22-25H,1-2,5-6,11H2/t14-/m0/s1 |
InChI Key | MVIYWFBLVAFZID-AWEZNQCLSA-N |
Boiling Point | 679.6±55.0 °C |
Purity | 98% |
Density | 1.362±0.06 g/ml |
pKa | 9.76±0.10 |
Appearance | Solid |
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