D 048
4-(4-tert-butylphenoxy)oct-6-yn-3-yl hydrogen sulfite
Also Known As: D-048|4-(4-tert-butylphenoxy)oct-6-yn-3-yl hydrogen sulfite|D 048|1-(2-Butynyl)-1-(p-tert-butylphenoxy)-2-butyl sulfite
CAS: 5345-36-8
| Molecular Formula | C18H26O4S |
|---|---|
| Molecular Weight | 338.15518 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 75.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 338.15518 |
| Monoisotopic Mass | 338.15518 |
| Heavy Atoms | 23 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 5345-36-8 |
|---|---|
| SMILES | CCC(C(CC#CC)OC1=CC=C(C=C1)C(C)(C)C)OS(=O)O |
| InChIKey | JGHWYUPYMGVCPJ-UHFFFAOYSA-N |
Product Overview
D 048 (CAS 5345-36-8), with molecular formula C18H26O4S and molecular weight 338.15518 g/mol. IUPAC: 4-(4-tert-butylphenoxy)oct-6-yn-3-yl hydrogen sulfite.
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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