| CAS Number | 30236-48-7 |
| Catalog Number | AG00BIER(AGN-PC-00GTF7) |
| Chemical Name | 2-Hydroxy-3-(thiophen-2-YL)pyridine |
| IUPAC Name | 3-thiophen-2-yl-1H-pyridin-2-one |
| InChI | InChI=1S/C9H7NOS/c11-9-7(3-1-5-10-9)8-4-2-6-12-8/h1-6H,(H,10,11) |
| InChI Key | IIAAHZBEMDRXCR-UHFFFAOYSA-N |
| MDL Number | MFCD18311917 |
| Molecular Formula | C9H7NOS |
| Molecular Weight | 177.2230 |
| SMILES | Oc1ncccc1c1cccs1 |
| Synonyms | 2-HYDROXY-3-(THIOPHEN-2-YL)PYRIDINE,
30236-48-7,
3-thiophen-2-yl-1H-pyridin-2-one,
SCHEMBL1981532,
DTXSID40473719,
MFCD18311917,
ZINC36458999,
AKOS006317734,
CJ-18919,
V5020,
K-7275,
C9H7NOS,
CID11819580,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.221g/mol |
| Monoisotopic Mass | 177.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number