Showing Metabocard for 5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene (BASm0000486)
| Common Name | 5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C16H14O4S2 |
| Average Mass | 334.40000 |
| Monoisotopic Mass | 334.03335 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CC(=O)OCC(C#Cc1ccc(-c2cccs2)s1)OC(C)=O |
| InChI Identifier | InChI=1S/C16H14O4S2/c1-11(17)19-10-13(20-12(2)18)5-6-14-7-8-16(22-14)15-4-3-9-21-15/h3-4,7-9,13H,10H2,1-2H3 |
| InChI Key | RGIIXLVKXLFDLP-UHFFFAOYSA-N |
| CHEBI ID | CHEBI:16013 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |