| CAS Number | 1716-83-2 |
| Catalog Number | AG007WMY(AGN-PC-05F1OE) |
| Chemical Name | Ethyl 2-(4-bromo-2-fluorophenoxy)acetate |
| IUPAC Name | ethyl 2-(4-bromo-2-fluorophenoxy)acetate |
| InChI | InChI=1S/C10H10BrFO3/c1-2-14-10(13)6-15-9-4-3-7(11)5-8(9)12/h3-5H,2,6H2,1H3 |
| InChI Key | XITJRVRFUOHXCN-UHFFFAOYSA-N |
| MDL Number | MFCD11174617 |
| Molecular Formula | C10H10BrFO3 |
| Molecular Weight | 277.0870 |
| SMILES | CCOC(COC1=C(F)C=C(Br)C=C1)=O |
| Synonyms | ethyl 2-(4-bromo-2-fluorophenoxy)acetate,
1716-83-2,
NE30427,
ethyl (4-bromo-2-fluorophenoxy)acetate,
EN300-59088,
Acetic acid, (4-bromo-2-fluorophenoxy)-, ethyl ester,
Ethyl 2-(4-bromo-2-fluoro-phenoxy)acetate,
AC1Q351A,
CTK0A7996,
DTXSID10651709,
ZINC20302588,
AKOS008018554,
MCULE-2357026709,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.98g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.089g/mol |
| Monoisotopic Mass | 275.98g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number