| CAS Number | 142946-79-0 |
| Catalog Number | AG007KIN(AGN-PC-0NHNJY) |
| Chemical Name | 2,2'-Bipyridine, 4,4'-bis(trifluoromethyl)- |
| IUPAC Name | 4-(trifluoromethyl)-2-[4-(trifluoromethyl)pyridin-2-yl]pyridine |
| InChI | InChI=1S/C12H6F6N2/c13-11(14,15)7-1-3-19-9(5-7)10-6-8(2-4-20-10)12(16,17)18/h1-6H |
| InChI Key | FFOMEQIMPYKURW-UHFFFAOYSA-N |
| MDL Number | MFCD00233878 |
| Molecular Formula | C12H6F6N2 |
| Molecular Weight | 292.1799 |
| SMILES | FC(c1ccnc(c1)c1nccc(c1)C(F)(F)F)(F)F |
| Synonyms | 4,4'-bis(trifluoromethyl)-2,2'-bipyridine,
142946-79-0,
2,2'-Bipyridine, 4,4'-bis(trifluoromethyl)-,
ACMC-20n1y2,
SCHEMBL810884,
CTK0B5433,
DTXSID80476648,
CS-0081529,
4-(trifluoromethyl)-2-[4-(trifluoromethyl)pyridin-2-yl]pyridine,
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| Complexity | 295 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.184g/mol |
| Monoisotopic Mass | 292.044g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number