| CAS Number | 1421602-69-8 |
| Catalog Number | AG01A12L(AGN-PC-0WOC6S) |
| Chemical Name | 5-(Pyridin-3-yl)thiophene-2-carboxylic acid hydrochloride |
| IUPAC Name | 5-pyridin-3-ylthiophene-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C10H7NO2S.ClH/c12-10(13)9-4-3-8(14-9)7-2-1-5-11-6-7;/h1-6H,(H,12,13);1H |
| InChI Key | LOYYXDUQASQOOD-UHFFFAOYSA-N |
| MDL Number | MFCD22392145 |
| Molecular Formula | C10H8ClNO2S |
| Molecular Weight | 241.6940 |
| SMILES | Cl.OC(C1SC(C2=CN=CC=C2)=CC=1)=O |
| Synonyms | 5-(pyridin-3-yl)thiophene-2-carboxylic acid hydrochloride,
1421602-69-8,
AKOS026730000,
MCULE-8917271955,
NE51066,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.689g/mol |
| Monoisotopic Mass | 240.996g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number