3-(4-(2-Carboxy-ethyl)-2,5-dimethoxy-phenyl)-propionic acid
3-[4-(2-carboxyethyl)-2,5-dimethoxyphenyl]propanoic acid
Also Known As: 3-(4-(2-CARBOXY-ETHYL)-2,5-DIMETHOXY-PHENYL)-PROPIONIC ACID|3-[4-(2-carboxyethyl)-2,5-dimethoxy-phenyl]propanoic Acid|3-[4-(2-carboxyethyl)-2,5-dimethoxyphenyl]propanoic acid
CAS: 40995-85-5
| Molecular Formula | C14H18O6 |
|---|---|
| Molecular Weight | 282.11035 g/mol |
| LogP | 1.7382 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 282.11035 |
| Monoisotopic Mass | 282.11035 |
| Heavy Atoms | 20 |
| Complexity | 448.93265 |
Chemical Identifiers
| CAS Number | 40995-85-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1CCC(=O)O)OC)CCC(=O)O |
Product Overview
3-(4-(2-Carboxy-ethyl)-2,5-dimethoxy-phenyl)-propionic acid (CAS 40995-85-5), with molecular formula C14H18O6 and molecular weight 282.11035 g/mol. IUPAC: 3-[4-(2-carboxyethyl)-2,5-dimethoxyphenyl]propanoic 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.
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