CAS | 135531-75-8 |
Synonyms | 1-[2-(1,2-Dihydroxy-1-methylethyl)-2,3-dihydro-6-hydroxy-5-benzofuranyl]ethanone |
IUPAC Name | 1-[2-(1,2-dihydroxypropan-2-yl)-6-hydroxy-2,3-dihydro-1-benzofuran-5-yl]ethanone |
Molecular Weight | 252.26 |
Molecular Formula | C13H16O5 |
Canonical SMILES | CC(=O)C1=C(C=C2C(=C1)CC(O2)C(C)(CO)O)O |
InChI | InChI=1S/C13H16O5/c1-7(15)9-3-8-4-12(13(2,17)6-14)18-11(8)5-10(9)16/h3,5,12,14,16-17H,4,6H2,1-2H3 |
InChI Key | SHYHWQIISKJNHX-UHFFFAOYSA-N |
Boiling Point | 494.7±45.0 °C |
Purity | 98% |
Density | 1.368±0.06 g/ml |
pKa | 10.09±0.40 |
Appearance | Solid |
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