| CAS Number | 57892-72-5 |
| Catalog Number | AG00ELVR(AGN-PC-0NI7PF) |
| Chemical Name | 2-(Imidazo[1,2-a]pyrimidin-2-yl)acetonitrile |
| IUPAC Name | 2-imidazo[1,2-a]pyrimidin-2-ylacetonitrile |
| InChI | InChI=1S/C8H6N4/c9-3-2-7-6-12-5-1-4-10-8(12)11-7/h1,4-6H,2H2 |
| InChI Key | FGIWVXCUJWKYCS-UHFFFAOYSA-N |
| MDL Number | MFCD16038306 |
| Molecular Formula | C8H6N4 |
| Molecular Weight | 158.1600 |
| SMILES | N#CCc1cn2cccnc2n1 |
| Synonyms | 57892-72-5,
2-(Imidazo[1,2-a]pyrimidin-2-yl)acetonitrile,
Imidazo[1,2-a]pyrimidine-2-acetonitrile,
CTK1F1040,
DTXSID40482104,
ZINC75543414,
AKOS022635758,
CS-0060098,
2-(imidazo[1,2-a]pyrazin-2-yl)acetonitrile,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.164g/mol |
| Monoisotopic Mass | 158.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number