Thiarubrine D
2-[4-(6-prop-1-ynyldithiin-3-yl)buta-1,3-diynyl]oxirane
CAS: 126624-07-5
| Molecular Formula | C13H8OS2 |
|---|---|
| Molecular Weight | 244.3 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.1 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.00166 |
| Heavy Atoms | 16 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 126624-07-5 |
|---|---|
| SMILES | CC#CC1=CC=C(SS1)C#CC#CC2CO2 |
| InChIKey | UNABNUQQYPYJEQ-UHFFFAOYSA-N |
📖 Product Overview
Thiarubrine D (CAS: 126624-07-5) is a chemical compound with molecular formula C13H8OS2 and molecular weight 244.3 g/mol. Its IUPAC systematic name is 2-[4-(6-prop-1-ynyldithiin-3-yl)buta-1,3-diynyl]oxirane.
UNABNUQQYPYJEQ-UHFFFAOYSA-N.
SMILES: CC#CC1=CC=C(SS1)C#CC#CC2CO2.
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
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What documentation do you provide with the product?
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