| CAS Number | 1269151-38-3 |
| Catalog Number | AG019RPZ |
| Chemical Name | Ethyl 2,2,2-trifluoroethyl oxalate |
| IUPAC Name | 1-O-ethyl 2-O-(2,2,2-trifluoroethyl) oxalate |
| InChI | InChI=1S/C6H7F3O4/c1-2-12-4(10)5(11)13-3-6(7,8)9/h2-3H2,1H3 |
| InChI Key | KWTUHAQSICWITR-UHFFFAOYSA-N |
| MDL Number | MFCD18380785 |
| Molecular Formula | C6H7F3O4 |
| Molecular Weight | 200.1126 |
| SMILES | CCOC(C(OCC(F)(F)F)=O)=O |
| Synonyms | ethyl 2,2,2-trifluoroethyl oxalate,
1269151-38-3,
SCHEMBL18211788,
ZINC60280143,
NE16308,
EN300-90152,
AC1Q31YV,
ethyl (2,2,2-trifluoroethyl) oxalate,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.029643g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.11g/mol |
| Monoisotopic Mass | 200.029643g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 52.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number