| CAS Number | 1240618-39-6 |
| Catalog Number | AG01DQSZ |
| Chemical Name | 2-(6-Chloropyridin-3-Yl)-2,2-Difluoroacetic Acid |
| IUPAC Name | 2-(6-chloropyridin-3-yl)-2,2-difluoroacetic acid |
| InChI | InChI=1S/C7H4ClF2NO2/c8-5-2-1-4(3-11-5)7(9,10)6(12)13/h1-3H,(H,12,13) |
| InChI Key | GUCQWXJYYAHXSP-UHFFFAOYSA-N |
| MDL Number | MFCD16988521 |
| Molecular Formula | C7H4ClF2NO2 |
| Molecular Weight | 207.5620 |
| SMILES | OC(C(C1=CN=C(Cl)C=C1)(F)F)=O |
| Synonyms | 2-(6-chloropyridin-3-yl)-2,2-difluoroacetic acid,
1240618-39-6,
AKOS024132219,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.561g/mol |
| Monoisotopic Mass | 206.99g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number