Isoamericanin A
3-[2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enal
Also Known As: Isoamericanin A|3-[2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enal
CAS: 69506-79-2
| Molecular Formula | C18H16O6 |
|---|---|
| Molecular Weight | 328.0947 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0947 |
| Monoisotopic Mass | 328.0947 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 69506-79-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1C=CC=O)OC(C(O2)C3=CC(=C(C=C3)O)O)CO |
| InChIKey | NTXXGPYGMQQSML-UHFFFAOYSA-N |
Product Overview
Isoamericanin A (CAS 69506-79-2), with molecular formula C18H16O6 and molecular weight 328.0947 g/mol. IUPAC: 3-[2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]prop-2-enal.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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