| CAS Number | 1189852-04-7 |
| Catalog Number | AG01BWC8(AGN-PC-0WNNDR) |
| Chemical Name | 7-Chloropyrazolo[1,5-a]pyrimidin-5-amine |
| IUPAC Name | 7-chloropyrazolo[1,5-a]pyrimidin-5-amine |
| InChI | InChI=1S/C6H5ClN4/c7-4-3-5(8)10-6-1-2-9-11(4)6/h1-3H,(H2,8,10) |
| InChI Key | RQDAMMMLPCIRCS-UHFFFAOYSA-N |
| MDL Number | MFCD20703106 |
| Molecular Formula | C6H5ClN4 |
| Molecular Weight | 168.5837 |
| SMILES | NC1=NC2N(N=CC=2)C(Cl)=C1 |
| Synonyms | 7-chloropyrazolo[1,5-a]pyrimidin-5-amine,
1189852-04-7,
SCHEMBL1018372,
RQDAMMMLPCIRCS-UHFFFAOYSA-N,
ZINC115044658,
N/A,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.584g/mol |
| Monoisotopic Mass | 168.02g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 56.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number