| CAS Number | 265650-09-7 |
| Catalog Number | AG01EJBY |
| Chemical Name | ethyl 2-amino-5-methoxy-4-methylthiophene-3-carboxylate |
| IUPAC Name | ethyl 2-amino-5-methoxy-4-methylthiophene-3-carboxylate |
| InChI | InChI=1S/C9H13NO3S/c1-4-13-8(11)6-5(2)9(12-3)14-7(6)10/h4,10H2,1-3H3 |
| InChI Key | UYDOEMWXYZCHMX-UHFFFAOYSA-N |
| MDL Number | MFCD24626518 |
| Molecular Formula | C9H13NO3S |
| Molecular Weight | 215.2694 |
| SMILES | CCOC(C1=C(N)SC(OC)=C1C)=O |
| Synonyms | ethyl 2-amino-5-methoxy-4-methylthiophene-3-carboxylate,
SCHEMBL2773935,
UYDOEMWXYZCHMX-UHFFFAOYSA-N,
AKOS034181132,
2-Amino-4-methyl-5-methoxythiophene-3-carboxylic acid ethyl ester,
265650-09-7,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.267g/mol |
| Monoisotopic Mass | 215.062g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 89.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
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