| CAS Number | 1228665-87-9 |
| Catalog Number | AG00HH3D(AGN-PC-0WBQUS) |
| Chemical Name | 2-Fluoro-6-(pyrrolidin-1-yl)nicotinonitrile |
| IUPAC Name | 2-fluoro-6-pyrrolidin-1-ylpyridine-3-carbonitrile |
| InChI | InChI=1S/C10H10FN3/c11-10-8(7-12)3-4-9(13-10)14-5-1-2-6-14/h3-4H,1-2,5-6H2 |
| InChI Key | JBPGNRHVOLTXAJ-UHFFFAOYSA-N |
| MDL Number | MFCD15530300 |
| Molecular Formula | C10H10FN3 |
| Molecular Weight | 191.2049 |
| SMILES | N#Cc1ccc(nc1F)N1CCCC1 |
| Synonyms | 2-Fluoro-6-(pyrrolidin-1-yl)nicotinonitrile,
1228665-87-9,
AC1Q4KZN,
CTK7C8269,
2614AD,
MFCD15530300,
ZINC39961342,
AKOS006332993,
TR-071304,
K-1737,
2-fluoro-6-(pyrrolidin-1-yl)pyridine-3-carbonitrile,
2-Fluoro-6-(pyrrolidin-1-yl)nicotinonitrile, AldrichCPR,
C10H10FN3,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.209g/mol |
| Monoisotopic Mass | 191.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number