| CAS Number | 2138411-53-5 |
| Catalog Number | AG01ELZ3 |
| Chemical Name | ethyl 4-chloro-3,3-difluorobutanoate |
| IUPAC Name | ethyl 4-chloro-3,3-difluorobutanoate |
| InChI | InChI=1S/C6H9ClF2O2/c1-2-11-5(10)3-6(8,9)4-7/h2-4H2,1H3 |
| InChI Key | ZWTTYVQTFNGJQS-UHFFFAOYSA-N |
| MDL Number | MFCD31447135 |
| Molecular Formula | C6H9ClF2O2 |
| Molecular Weight | 186.5843 |
| SMILES | ClCC(CC(=O)OCC)(F)F |
| Synonyms | ethyl 4-chloro-3,3-difluorobutanoate,
2138411-53-5,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.583g/mol |
| Monoisotopic Mass | 186.026g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number