| CAS Number | 1820674-18-7 |
| Catalog Number | AG00I0RK |
| Chemical Name | Methyl 5-amino-6-(ethylamino)pyridine-3-carboxylate |
| IUPAC Name | methyl 5-amino-6-(ethylamino)pyridine-3-carboxylate |
| InChI | InChI=1S/C9H13N3O2/c1-3-11-8-7(10)4-6(5-12-8)9(13)14-2/h4-5H,3,10H2,1-2H3,(H,11,12) |
| InChI Key | JIUFYXSOIXEZIO-UHFFFAOYSA-N |
| MDL Number | MFCD26523340 |
| Molecular Formula | C9H13N3O2 |
| Molecular Weight | 195.2184 |
| SMILES | CCNc1ncc(cc1N)C(=O)OC |
| Synonyms | METHYL 5-AMINO-6-(ETHYLAMINO)PYRIDINE-3-CARBOXYLATE,
1820674-18-7,
Methyl 5-amino-6-(ethylamino)nicotinate,
KM5555,
ZINC95495995,
Y2941,
C9H13N3O2,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.222g/mol |
| Monoisotopic Mass | 195.101g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 77.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number