Benzoic acid, p-(pentylsulfonyl)-
4-pentylsulfonylbenzoic acid
Also Known As: 4-pentylsulfonylbenzoic Acid|Benzoic acid, p-(pentylsulfonyl)-|4-(pentylsulfonyl)Benzoic acid|4-(Pentane-1-sulfonyl)benzoic acid
CAS: 32910-75-1
| Molecular Formula | C12H16O4S |
|---|---|
| Molecular Weight | 256.07693 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.07693 |
| Monoisotopic Mass | 256.07693 |
| Heavy Atoms | 17 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 32910-75-1 |
|---|---|
| SMILES | CCCCCS(=O)(=O)C1=CC=C(C=C1)C(=O)O |
| InChIKey | PONXTRASYKQAIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (4 patents)
Product Overview
Benzoic acid, p-(pentylsulfonyl)- (CAS 32910-75-1), with molecular formula C12H16O4S and molecular weight 256.07693 g/mol. IUPAC: 4-pentylsulfonylbenzoic 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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