Buellolide
4-chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxy-3H-2-benzofuran-1-one
Also Known As: NCI60_003238|4-chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-me|4-Chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxyisobenzofuran-1(3H)-one|4-Chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxy-2-benzofuran-1(3H)-one|4-chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxy-3H-2-benzofuran-1-one|4-chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxy-1,3-dihydro-2-benzofuran-1-one
CAS: 69799-33-3
| Molecular Formula | C18H15Cl3O6 |
|---|---|
| Molecular Weight | 431.9934 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.9934 |
| Monoisotopic Mass | 431.9934 |
| Heavy Atoms | 27 |
| Complexity | 537.0 |
Chemical Identifiers
| CAS Number | 69799-33-3 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1Cl)OC)Cl)OC)OC2=CC(=C(C3=C2C(=O)OC3)Cl)OC |
| InChIKey | OXWGVBMJMQGGEG-UHFFFAOYSA-N |
Product Overview
Buellolide (CAS 69799-33-3), with molecular formula C18H15Cl3O6 and molecular weight 431.9934 g/mol. IUPAC: 4-chloro-7-(3,5-dichloro-2,4-dimethoxy-6-methylphenoxy)-5-methoxy-3H-2-benzofuran-1-one.
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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