| CAS Number | 1384431-26-8 |
| Catalog Number | AG019YBV |
| Chemical Name | Ethyl 4,4-diethoxy-2-fluorobutanoate |
| IUPAC Name | ethyl 4,4-diethoxy-2-fluorobutanoate |
| InChI | InChI=1S/C10H19FO4/c1-4-13-9(14-5-2)7-8(11)10(12)15-6-3/h8-9H,4-7H2,1-3H3 |
| InChI Key | XKUOYWPHDDHSKU-UHFFFAOYSA-N |
| MDL Number | MFCD22056382 |
| Molecular Formula | C10H19FO4 |
| Molecular Weight | 222.2539 |
| SMILES | CCOC(OCC)CC(C(OCC)=O)F |
| Synonyms | ethyl 4,4-diethoxy-2-fluorobutanoate,
1384431-26-8,
NE54603,
J3.495.539E,
2-Fluoro-4,4-diethoxybutyric acid ethyl ester,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.256g/mol |
| Monoisotopic Mass | 222.127g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 44.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number