| CAS Number | 1036762-04-5 |
| Catalog Number | AG00HA5O |
| Chemical Name | 6-(4-Fluorophenyl)pyrazolo[1,5-a]pyrimidine |
| IUPAC Name | 6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine |
| InChI | InChI=1S/C12H8FN3/c13-11-3-1-9(2-4-11)10-7-14-12-5-6-15-16(12)8-10/h1-8H |
| InChI Key | QATNPTKCVXWGFB-UHFFFAOYSA-N |
| MDL Number | MFCD28405285 |
| Molecular Formula | C12H8FN3 |
| Molecular Weight | 213.2104 |
| SMILES | FC1=CC=C(C=C1)C1=CN2N=CC=C2N=C1 |
| Synonyms | 6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine,
1036762-04-5,
Pyrazolo[1,5-a]pyrimidine,6-(4-fluorophenyl)-,
SCHEMBL13336472,
MFCD28405285,
AK335638,
DS-12413,
|
| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.215g/mol |
| Monoisotopic Mass | 213.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number