| CAS Number | 187733-13-7 |
| Catalog Number | AG00ACCO(AGN-PC-0BLD69) |
| Chemical Name | ethyl 3-aminothieno[3,2-c]pyridine-2-carboxylate |
| IUPAC Name | ethyl 3-aminothieno[3,2-c]pyridine-2-carboxylate |
| InChI | InChI=1S/C10H10N2O2S/c1-2-14-10(13)9-8(11)6-5-12-4-3-7(6)15-9/h3-5H,2,11H2,1H3 |
| InChI Key | FCUBMCXQOVJZFT-UHFFFAOYSA-N |
| MDL Number | MFCD12024771 |
| Molecular Formula | C10H10N2O2S |
| Molecular Weight | 222.2636 |
| SMILES | CCOC(C1=C(N)C2=C(C=CN=C2)S1)=O |
| Synonyms | ETHYL 3-AMINOTHIENO[3,2-C]PYRIDINE-2-CARBOXYLATE,
187733-13-7,
SCHEMBL4724788,
FCUBMCXQOVJZFT-UHFFFAOYSA-N,
ZINC44831949,
AKOS024182973,
ACM187733137,
EN300-140649,
J-012083,
3-Amino-thieno[3,2-c]pyridine-2-carboxylic acid ethyl ester,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.262g/mol |
| Monoisotopic Mass | 222.046g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 93.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number