| CAS Number | 1536794-94-1 |
| Catalog Number | AG01BZRU |
| Chemical Name | 6-Chlorothieno[2,3-b]pyridine-2-carboxylic acid |
| IUPAC Name | 6-chlorothieno[2,3-b]pyridine-2-carboxylic acid |
| InChI | InChI=1S/C8H4ClNO2S/c9-6-2-1-4-3-5(8(11)12)13-7(4)10-6/h1-3H,(H,11,12) |
| InChI Key | BJOOZLSQNAOOBN-UHFFFAOYSA-N |
| MDL Number | MFCD30486768 |
| Molecular Formula | C8H4ClNO2S |
| Molecular Weight | 213.6409 |
| SMILES | ClC1=CC=C2C(=N1)SC(=C2)C(=O)O |
| Synonyms | 6-Chlorothieno[2,3-b]pyridine-2-carboxylic acid,
1536794-94-1,
SCHEMBL18249385,
ZINC84236174,
AKOS023399976,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.635g/mol |
| Monoisotopic Mass | 212.965g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number