| CAS Number | 1355247-03-8 |
| Catalog Number | AG007LE0(AGN-PC-0J2C3T) |
| Chemical Name | 2-Ethoxy-1-fluoro-4-(trifluoromethoxy)benzene |
| IUPAC Name | 2-ethoxy-1-fluoro-4-(trifluoromethoxy)benzene |
| InChI | InChI=1S/C9H8F4O2/c1-2-14-8-5-6(3-4-7(8)10)15-9(11,12)13/h3-5H,2H2,1H3 |
| InChI Key | QSPDNRIILMLYEB-UHFFFAOYSA-N |
| MDL Number | MFCD21333100 |
| Molecular Formula | C9H8F4O2 |
| Molecular Weight | 224.1522 |
| SMILES | CCOc1cc(ccc1F)OC(F)(F)F |
| Synonyms | 2-Ethoxy-1-fluoro-4-(trifluoromethoxy)benzene,
1355247-03-8,
ACMC-209c1a,
CTK8B0364,
DTXSID50742741,
ANW-19868,
MFCD21333100,
ZINC85476848,
TC-108613,
Z9953,
C9H8F4O2,
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| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.155g/mol |
| Monoisotopic Mass | 224.046g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number