| CAS Number | 1909318-68-8 |
| Catalog Number | AG00J3EU(AGN-PC-0WRAVC) |
| Chemical Name | 3-methylimidazo[1,2-a]pyrimidine-2-carboxylic acid |
| IUPAC Name | 3-methylimidazo[1,2-a]pyrimidine-2-carboxylic acid |
| InChI | InChI=1S/C8H7N3O2/c1-5-6(7(12)13)10-8-9-3-2-4-11(5)8/h2-4H,1H3,(H,12,13) |
| InChI Key | SBBRLLGSQUCNJO-UHFFFAOYSA-N |
| MDL Number | MFCD29127446 |
| Molecular Formula | C8H7N3O2 |
| Molecular Weight | 177.1601 |
| SMILES | C1(C(O)=O)=C(C)N2C(N=CC=C2)=N1 |
| Synonyms | 3-Methylimidazo[1,2-a]pyrimidine-2-carboxylic acid,
1909318-68-8,
ZX-CM014602,
MFCD29127446,
AKOS030631320,
ZINC299738112,
N/A,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.163g/mol |
| Monoisotopic Mass | 177.054g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 67.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number