| CAS Number | 1531209-75-2 |
| Catalog Number | AG01FBPD(AGN-PC-3H49JN) |
| Chemical Name | Ethyl 2-(5-chloro-2-fluorophenoxy)acetate |
| IUPAC Name | ethyl 2-(5-chloro-2-fluorophenoxy)acetate |
| InChI | InChI=1S/C10H10ClFO3/c1-2-14-10(13)6-15-9-5-7(11)3-4-8(9)12/h3-5H,2,6H2,1H3 |
| InChI Key | QXIYHHNMVIGDOF-UHFFFAOYSA-N |
| MDL Number | MFCD28134441 |
| Molecular Formula | C10H10ClFO3 |
| Molecular Weight | 232.636 |
| SMILES | CCOC(=O)COc1cc(Cl)ccc1F |
| Synonyms | Ethyl 2-(5-chloro-2-fluorophenoxy)acetate,
1531209-75-2,
ZINC75880773,
AKOS023110612,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.635g/mol |
| Monoisotopic Mass | 232.03g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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