3,4,5-Trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic acid
3,4,5-trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic acid
Also Known As: 2-Phenethyl Glucuronide|2-Phenylethanol, glucuronide|3,4,5-trihydroxy-6-phenethyloxyoxane-2-carboxylic acid|(2S,3s,4s,5r)-3,4,5-trihydroxy-6-(2-phenylethoxy)tetrahydropyran-2-carboxylic acid
CAS: 18997-55-2
| Molecular Formula | C14H18O7 |
|---|---|
| Molecular Weight | 298.10526 g/mol |
| LogP | -0.8621 |
| Topological Polar Surface Area | 116.45 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.10526 |
| Monoisotopic Mass | 298.10526 |
| Heavy Atoms | 21 |
| Complexity | 463.65015 |
Chemical Identifiers
| CAS Number | 18997-55-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC2C(C(C(C(O2)C(=O)O)O)O)O |
Product Overview
3,4,5-Trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic acid (CAS 18997-55-2), with molecular formula C14H18O7 and molecular weight 298.10526 g/mol. IUPAC: 3,4,5-trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic 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 →
3,4,5-Trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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