| CAS Number | 893723-60-9 |
| Catalog Number | AG00IFNG(AGN-PC-0WBQG6) |
| Chemical Name | 2-(thiophen-3-yl)pyridine-3-carboxylic acid |
| IUPAC Name | 2-thiophen-3-ylpyridine-3-carboxylic acid |
| InChI | InChI=1S/C10H7NO2S/c12-10(13)8-2-1-4-11-9(8)7-3-5-14-6-7/h1-6H,(H,12,13) |
| InChI Key | ANOOBNFJKSQNMY-UHFFFAOYSA-N |
| MDL Number | MFCD00172036 |
| Molecular Formula | C10H7NO2S |
| Molecular Weight | 205.2331 |
| SMILES | OC(C1=C(C2=CSC=C2)N=CC=C1)=O |
| Synonyms | 2-(THIOPHEN-3-YL)NICOTINIC ACID,
893723-60-9,
2-thiophen-3-ylpyridine-3-carboxylic Acid,
AC1NHF3Z,
SCHEMBL5174868,
DTXSID00406260,
MFCD06496473,
ZINC34924630,
AKOS002664568,
F2167-2357,
CID4739103,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.231g/mol |
| Monoisotopic Mass | 205.02g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number