| CAS Number | 910468-48-3 |
| Catalog Number | AG01A84Y |
| Chemical Name | 1-(2-Bromoethoxy)-2-(trifluoromethyl)benzene |
| IUPAC Name | 1-(2-bromoethoxy)-2-(trifluoromethyl)benzene |
| InChI | InChI=1S/C9H8BrF3O/c10-5-6-14-8-4-2-1-3-7(8)9(11,12)13/h1-4H,5-6H2 |
| InChI Key | IVMMPDGPQGYBAZ-UHFFFAOYSA-N |
| MDL Number | MFCD09948150 |
| Molecular Formula | C9H8BrF3O |
| Molecular Weight | 269.0584 |
| SMILES | BrCCOC1=C(C=CC=C1)C(F)(F)F |
| Synonyms | 1-(2-bromoethoxy)-2-(trifluoromethyl)benzene,
910468-48-3,
AC1Q4IQW,
Benzene, 1-(2-bromoethoxy)-2-(trifluoromethyl)-,
SCHEMBL17842217,
CTK5J0415,
ZINC19513576,
AKOS000193760,
NE29593,
EN300-60741,
A1-10345,
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| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.061g/mol |
| Monoisotopic Mass | 267.971g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number