| CAS Number | 1206249-51-5 |
| Catalog Number | AG01C1H0 |
| Chemical Name | 2-Amino-6-chloropyrimidine-4-carboxylic acid |
| IUPAC Name | 2-amino-6-chloropyrimidine-4-carboxylic acid |
| InChI | InChI=1S/C5H4ClN3O2/c6-3-1-2(4(10)11)8-5(7)9-3/h1H,(H,10,11)(H2,7,8,9) |
| InChI Key | ZRDOONGJQRERAD-UHFFFAOYSA-N |
| MDL Number | MFCD14582106 |
| Molecular Formula | C5H4ClN3O2 |
| Molecular Weight | 173.5572 |
| SMILES | NC1=NC(C(O)=O)=CC(Cl)=N1 |
| Synonyms | 2-Amino-6-chloropyrimidine-4-carboxylic acid,
1206249-51-5,
ZINC84325701,
AKOS023413721,
2-Amino-6-chloro-4-pyrimidinecarboxylic acid,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.556g/mol |
| Monoisotopic Mass | 172.999g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 89.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number