| CAS Number | 1339179-12-2 |
| Catalog Number | AG01C3KZ |
| Chemical Name | 5-(Methylamino)pyrazine-2-carboxylic acid |
| IUPAC Name | 5-(methylamino)pyrazine-2-carboxylic acid |
| InChI | InChI=1S/C6H7N3O2/c1-7-5-3-8-4(2-9-5)6(10)11/h2-3H,1H3,(H,7,9)(H,10,11) |
| InChI Key | VXNLGXWAVJKURT-UHFFFAOYSA-N |
| MDL Number | MFCD20284425 |
| Molecular Formula | C6H7N3O2 |
| Molecular Weight | 153.1387 |
| SMILES | O=C(C1=NC=C(NC)N=C1)O |
| Synonyms | 5-(methylamino)pyrazine-2-carboxylic acid,
1339179-12-2,
SCHEMBL17827865,
ZINC70582273,
AKOS013592670,
Z2379087801,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.141g/mol |
| Monoisotopic Mass | 153.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 75.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number