| CAS Number | 1248094-19-0 |
| Catalog Number | AG01C371 |
| Chemical Name | 2-(2,3-dichlorophenyl)-2,2-difluoroacetic acid |
| IUPAC Name | 2-(2,3-dichlorophenyl)-2,2-difluoroacetic acid |
| InChI | InChI=1S/C8H4Cl2F2O2/c9-5-3-1-2-4(6(5)10)8(11,12)7(13)14/h1-3H,(H,13,14) |
| InChI Key | AROJLPLOIFNGFG-UHFFFAOYSA-N |
| MDL Number | MFCD16748864 |
| Molecular Formula | C8H4Cl2F2O2 |
| Molecular Weight | 241.0190 |
| SMILES | OC(C(C1=C(Cl)C(Cl)=CC=C1)(F)F)=O |
| Synonyms | 2-(2,3-dichlorophenyl)-2,2-difluoroacetic acid,
1248094-19-0,
ZINC52232596,
AKOS011682265,
Z2412196577,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.015g/mol |
| Monoisotopic Mass | 239.956g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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Certificate of Analysis
Lot Number