| CAS Number | 32704-60-2 |
| Catalog Number | AG01C1RB |
| Chemical Name | Ethyl Imidazo[1,5-A]Pyrimidine-8-Carboxylate |
| IUPAC Name | ethyl imidazo[1,5-a]pyrimidine-8-carboxylate |
| InChI | InChI=1S/C9H9N3O2/c1-2-14-9(13)7-8-10-4-3-5-12(8)6-11-7/h3-6H,2H2,1H3 |
| InChI Key | AAACGYHXZZHSMQ-UHFFFAOYSA-N |
| MDL Number | MFCD28964046 |
| Molecular Formula | C9H9N3O2 |
| Molecular Weight | 191.1867 |
| SMILES | CCOC(C1=C2N(C=CC=N2)C=N1)=O |
| Synonyms | ethyl imidazo[1,5-a]pyrimidine-8-carboxylate,
32704-60-2,
AKOS033932020,
ZINC259814846,
Z2507919903,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.19g/mol |
| Monoisotopic Mass | 191.069g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number