1,3-Benzodioxole, 5-(hexyloxy)-
5-hexoxy-1,3-benzodioxole
Also Known As: 1,3-Benzodioxole, 5-(hexyloxy)-|5-hexoxy-1,3-benzodioxole|5-(hexyloxy)-2H-1,3-benzodioxole
CAS: 87590-45-2
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.1256 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 222.1256 |
| Monoisotopic Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 87590-45-2 |
|---|---|
| SMILES | CCCCCCOC1=CC2=C(C=C1)OCO2 |
| InChIKey | ACNOQMAOMHBNSS-UHFFFAOYSA-N |
Product Overview
1,3-Benzodioxole, 5-(hexyloxy)- (CAS 87590-45-2), with molecular formula C13H18O3 and molecular weight 222.1256 g/mol. IUPAC: 5-hexoxy-1,3-benzodioxole.
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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