| CAS Number | 1262413-59-1 |
| Catalog Number | AG01FL5E(AGN-PC-0WC5NE) |
| Chemical Name | 2-Chloro-4-(difluoromethyl)-3-fluoropyridine |
| IUPAC Name | 2-chloro-4-(difluoromethyl)-3-fluoropyridine |
| InChI | InChI=1S/C6H3ClF3N/c7-5-4(8)3(6(9)10)1-2-11-5/h1-2,6H |
| InChI Key | KXJSIJWAANCHGT-UHFFFAOYSA-N |
| MDL Number | MFCD18384831 |
| Molecular Formula | C6H3ClF3N |
| Molecular Weight | 181.5429 |
| SMILES | C1=CN=C(C(=C1C(F)F)F)Cl |
| Synonyms | 2-chloro-4-(difluoromethyl)-3-fluoropyridine,
1262413-59-1,
2-CHLORO-3-FLUORO-4-(DIFLUOROMETHYL)PYRIDINE,
CTK7B6914,
KS-00003R9Y,
ZX-AP000838,
BBL102711,
FCH898595,
KM5363,
MFCD18384831,
STL556517,
ZINC66323299,
AKOS005259209,
PC51086,
PS-8531,
TR-071768,
2-Chloro-alpha,alpha-3-trifluoro-4-picoline,
2-Chloro-4-(difluoromethyl)-3-fluoropyridine, AldrichCPR,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.542g/mol |
| Monoisotopic Mass | 180.991g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number