| CAS Number | 1375069-20-7 |
| Catalog Number | AG0013FN(AGN-PC-0J2CB3) |
| Chemical Name | 5-[4-Fluoro-3-(trifluoromethyl)phenyl]-2-methoxypyridine |
| IUPAC Name | 5-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methoxypyridine |
| InChI | InChI=1S/C13H9F4NO/c1-19-12-5-3-9(7-18-12)8-2-4-11(14)10(6-8)13(15,16)17/h2-7H,1H3 |
| InChI Key | FHIODCIAGGZQPW-UHFFFAOYSA-N |
| MDL Number | MFCD22205809 |
| Molecular Formula | C13H9F4NO |
| Molecular Weight | 271.2103 |
| SMILES | COc1ccc(cn1)c1ccc(c(c1)C(F)(F)F)F |
| Synonyms | 5-[4-Fluoro-3-(trifluoromethyl)phenyl]-2-methoxypyridine,
1375069-20-7,
ACMC-209cdq,
CTK8B0670,
DTXSID00743001,
ANW-20316,
MFCD22205809,
ZINC85477245,
CJ-22457,
TC-109061,
V2760,
B-8675,
Pyridine, 5-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methoxy-,
C13H9F4NO,
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| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.215g/mol |
| Monoisotopic Mass | 271.062g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number