| CAS Number | 1339147-37-3 |
| Catalog Number | AG01AMAW |
| Chemical Name | 2-(2,4-difluorophenyl)-2,2-difluoroacetic acid |
| IUPAC Name | 2-(2,4-difluorophenyl)-2,2-difluoroacetic acid |
| InChI | InChI=1S/C8H4F4O2/c9-4-1-2-5(6(10)3-4)8(11,12)7(13)14/h1-3H,(H,13,14) |
| InChI Key | BDQSGGPBZVNPRY-UHFFFAOYSA-N |
| MDL Number | MFCD17223575 |
| Molecular Formula | C8H4F4O2 |
| Molecular Weight | 208.1098 |
| SMILES | OC(C(C1=C(F)C=C(F)C=C1)(F)F)=O |
| Synonyms | 2-(2,4-difluorophenyl)-2,2-difluoroacetic acid,
1339147-37-3,
SCHEMBL17420624,
BDQSGGPBZVNPRY-UHFFFAOYSA-N,
AKOS012096283,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.112g/mol |
| Monoisotopic Mass | 208.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number