![2-[(1-Carboxyethyl)sulfanyl]benzoic acid structure](/static/products/7461/7461-86-1.webp)
2-[(1-Carboxyethyl)sulfanyl]benzoic acid
2-(1-carboxyethylsulfanyl)benzoic acid
Also Known As: 2-[(1-Carboxyethyl)sulfanyl]benzoic acid|2-(1-carboxyethylsulfanyl)benzoic acid|2-(1-hydroxy-1-oxopropan-2-yl)sulfanylbenzoic acid
CAS: 7461-86-1
| Molecular Formula | C10H10O4S |
|---|---|
| Molecular Weight | 226.02998 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 99.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.02998 |
| Monoisotopic Mass | 226.02998 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 7461-86-1 |
|---|---|
| SMILES | CC(C(=O)O)SC1=CC=CC=C1C(=O)O |
| InChIKey | YTONAIFUSYIRFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (2 patents)
Pharmaceutical Intermediates (2 patents)
Product Overview
2-[(1-Carboxyethyl)sulfanyl]benzoic acid (CAS 7461-86-1), with molecular formula C10H10O4S and molecular weight 226.02998 g/mol. IUPAC: 2-(1-carboxyethylsulfanyl)benzoic 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 →
2-[(1-Carboxyethyl)sulfanyl]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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