| CAS Number | 2710-66-9 |
| Catalog Number | AG01EAMD |
| Chemical Name | Diethyl 3,3-difluoropentanedioate |
| IUPAC Name | diethyl 3,3-difluoropentanedioate |
| InChI | InChI=1S/C9H14F2O4/c1-3-14-7(12)5-9(10,11)6-8(13)15-4-2/h3-6H2,1-2H3 |
| InChI Key | OJVISWAFWNHSSI-UHFFFAOYSA-N |
| MDL Number | MFCD12974638 |
| Molecular Formula | C9H14F2O4 |
| Molecular Weight | 224.2019 |
| SMILES | CCOC(=O)CC(CC(=O)OCC)(F)F |
| Synonyms | Diethyl 3,3-difluoropentanedioate,
2710-66-9,
Diethyl 3,3-difluoroglutarate,
SCHEMBL4007750,
DTXSID70507197,
OJVISWAFWNHSSI-UHFFFAOYSA-N,
ZINC44126287,
3,3-Difluoroglutaric acid diethyl ester,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.204g/mol |
| Monoisotopic Mass | 224.086g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number