CID9907678
2-[4-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid
Also Known As: alpha-[4-[(1E)-2-Carboxyethenyl]-2-hydroxyphenoxy]-beta,3,4-trihydroxybenzenepropanoic acid|(E)-3-[4-[1-carboxy-2-(3,4-dihydroxyphenyl)-2-hydroxy-ethoxy]-3-hydroxy-phenyl]prop-2-enoic Acid
CAS: 285136-03-0
| Molecular Formula | C18H16O9 |
|---|---|
| Molecular Weight | 376.07944 g/mol |
| LogP | 1.4668 |
| Topological Polar Surface Area | 164.75 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.07944 |
| Monoisotopic Mass | 376.07944 |
| Heavy Atoms | 27 |
| Complexity | 888.3962 |
Chemical Identifiers
| CAS Number | 285136-03-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1/C=C/C(=O)O)O)OC(C(C2=CC(=C(C=C2)O)O)O)C(=O)O |
Product Overview
CID9907678 (CAS 285136-03-0), with molecular formula C18H16O9 and molecular weight 376.07944 g/mol. IUPAC: 2-[4-[(E)-2-carboxyethenyl]-2-hydroxyphenoxy]-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid.
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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