| CAS Number | 1360944-09-7 |
| Catalog Number | AG019EV8 |
| Chemical Name | Dimethyl 3-(trifluoromethyl)pyridine-2,5-dicarboxylate |
| IUPAC Name | dimethyl 3-(trifluoromethyl)pyridine-2,5-dicarboxylate |
| InChI | InChI=1S/C10H8F3NO4/c1-17-8(15)5-3-6(10(11,12)13)7(14-4-5)9(16)18-2/h3-4H,1-2H3 |
| InChI Key | ZPEVKRYZDQEQDY-UHFFFAOYSA-N |
| MDL Number | MFCD31652783 |
| Molecular Formula | C10H8F3NO4 |
| Molecular Weight | 263.1700 |
| SMILES | C=1(C(=CC(=CN1)C(=O)OC)C(F)(F)F)C(=O)OC |
| Synonyms | Dimethyl 3-(trifluoromethyl)pyridine-2,5-dicarboxylate,
1360944-09-7,
AKOS030627401,
CS-0059862,
|
| Complexity | 332 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.172g/mol |
| Monoisotopic Mass | 263.041g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 65.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number