| CAS Number | 945971-02-8 |
| Catalog Number | AG01DMGE |
| Chemical Name | 2-Chloro-3-Methyl-6-(Trifluoromethyl)Pyridine |
| IUPAC Name | 2-chloro-3-methyl-6-(trifluoromethyl)pyridine |
| InChI | InChI=1S/C7H5ClF3N/c1-4-2-3-5(7(9,10)11)12-6(4)8/h2-3H,1H3 |
| InChI Key | DRJRPUZFEGEAAT-UHFFFAOYSA-N |
| MDL Number | MFCD22581208 |
| Molecular Formula | C7H5ClF3N |
| Molecular Weight | 195.5695 |
| SMILES | ClC1=NC(=CC=C1C)C(F)(F)F |
| Synonyms | 2-Chloro-3-methyl-6-(trifluoromethyl)pyridine,
945971-02-8,
2- Chloro-3-methyl-6-(trifluoromethyl) pyridine,
SCHEMBL2269503,
DRJRPUZFEGEAAT-UHFFFAOYSA-N,
MFCD22581208,
ZINC87493251,
SC-53106,
X3330,
2-Chloro-3-methyl-6-(trifluoromethyl)-pyridine,
Pyridine, 2-chloro-3-methyl-6-(trifluoromethyl)-,
C7H5ClF3N,
-Chloro-3-methyl-6-(trifluoromethyl)-pyridine,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.569g/mol |
| Monoisotopic Mass | 195.006g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number