3-(Sulfooxy)benzenepropanoic acid
3-(3-sulfooxyphenyl)propanoic acid
Also Known As: mhppa sulfate|3-(3-sulfooxyphenyl)propanoic Acid|3-[3-(sulfooxy)phenyl]propanoic acid|3-(m-sulfooxyphenyl)propanoic acid|3-(3-(Sulfooxy)phenyl)propanoic acid|3-(Sulfooxy)benzenepropanoic acid|3-(3-hydroxyphenyl)propanoic acid sulfate|3-(3-(sulfooxy)phenyl) propanoic acid|3-(3-Hydroxyphenyl)propionic acid sulfate
CAS: 86321-32-6
| Molecular Formula | C9H10O6S |
|---|---|
| Molecular Weight | 246.0198 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.0198 |
| Monoisotopic Mass | 246.0198 |
| Heavy Atoms | 16 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 86321-32-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OS(=O)(=O)O)CCC(=O)O |
| InChIKey | IQWLPDPKVFZEOK-UHFFFAOYSA-N |
Product Overview
3-(Sulfooxy)benzenepropanoic acid (CAS 86321-32-6), with molecular formula C9H10O6S and molecular weight 246.0198 g/mol. IUPAC: 3-(3-sulfooxyphenyl)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.
View MSDS →
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