Butyl 4-methylbenzenesulfonate
butyl 4-methylbenzenesulfonate
CAS: 778-28-9
| Molecular Formula | C11H16O3S |
|---|---|
| Molecular Weight | 228.31 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 51.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.08202 |
| Heavy Atoms | 15 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 778-28-9 |
|---|---|
| SMILES | CCCCOS(=O)(=O)C1=CC=C(C=C1)C |
| InChIKey | QYJXDIUNDMRLAO-UHFFFAOYSA-N |
📖 Product Overview
Butyl 4-methylbenzenesulfonate (CAS: 778-28-9) is a chemical compound with molecular formula C11H16O3S and molecular weight 228.31 g/mol. Its IUPAC systematic name is butyl 4-methylbenzenesulfonate.
QYJXDIUNDMRLAO-UHFFFAOYSA-N.
SMILES: CCCCOS(=O)(=O)C1=CC=C(C=C1)C.
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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Frequently Asked Questions
What is the typical lead time for this product?
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What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
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📚 Academic Support
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