| CAS Number | 1228666-18-9 |
| Catalog Number | AG00HH3R(AGN-PC-0WBQV4) |
| Chemical Name | 2-Fluoro-6-(pyrrolidin-1-yl)isonicotinonitrile |
| IUPAC Name | 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carbonitrile |
| InChI | InChI=1S/C10H10FN3/c11-9-5-8(7-12)6-10(13-9)14-3-1-2-4-14/h5-6H,1-4H2 |
| InChI Key | DYIHMZYCJAYFFU-UHFFFAOYSA-N |
| MDL Number | MFCD15530272 |
| Molecular Formula | C10H10FN3 |
| Molecular Weight | 191.2049 |
| SMILES | N#Cc1cc(F)nc(c1)N1CCCC1 |
| Synonyms | 2-Fluoro-6-(pyrrolidin-1-yl)isonicotinonitrile,
1228666-18-9,
AC1Q4LIO,
CTK7C7333,
2639AD,
MFCD15530272,
ZINC39961272,
AKOS006332703,
TR-071259,
K-1747,
2-fluoro-6-(pyrrolidin-1-yl)pyridine-4-carbonitrile,
2-Fluoro-6-(pyrrolidin-1-yl)isonicotinonitrile, 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