| CAS Number | 1486165-39-2 |
| Catalog Number | AG01B9V8 |
| Chemical Name | Methyl 2,3-diaminopyridine-4-carboxylate |
| IUPAC Name | methyl 2,3-diaminopyridine-4-carboxylate |
| InChI | InChI=1S/C7H9N3O2/c1-12-7(11)4-2-3-10-6(9)5(4)8/h2-3H,8H2,1H3,(H2,9,10) |
| InChI Key | SLVVBSUMCKZAQX-UHFFFAOYSA-N |
| MDL Number | MFCD21288036 |
| Molecular Formula | C7H9N3O2 |
| Molecular Weight | 167.1653 |
| SMILES | COC(=O)c1ccnc(c1N)N |
| Synonyms | methyl 2,3-diaminopyridine-4-carboxylate,
1486165-39-2,
SCHEMBL18224721,
ZINC84095385,
AKOS015039408,
Z2050687863,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.168g/mol |
| Monoisotopic Mass | 167.069g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 91.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number