| CAS Number | 1378448-42-0 |
| Catalog Number | AG019VZU |
| Chemical Name | 5-Bromothieno[3,2-B]Thiophene-2-Carboxylic Acid |
| IUPAC Name | 5-bromothieno[3,2-b]thiophene-2-carboxylic acid |
| InChI | InChI=1S/C7H3BrO2S2/c8-6-2-4-3(12-6)1-5(11-4)7(9)10/h1-2H,(H,9,10) |
| InChI Key | PMZFZHLHTDFWBI-UHFFFAOYSA-N |
| MDL Number | MFCD20529147 |
| Molecular Formula | C7H3BrO2S2 |
| Molecular Weight | 263.1315 |
| SMILES | O=C(C1=CC2=C(C=C(S2)Br)S1)O |
| Synonyms | 5-Bromothieno[3,2-b]thiophene-2-carboxylic acid,
1378448-42-0,
SCHEMBL20444703,
CTK8E5208,
AKOS015835322,
TX-012641,
2-Bromo-5-iodo-thieno[3,2-b]thiophene,
1092352-28-7,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.876g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.123g/mol |
| Monoisotopic Mass | 261.876g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 93.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number