| CAS Number | 1355248-26-8 |
| Catalog Number | AG006YUB(AGN-PC-0J2C64) |
| Chemical Name | 4-Bromo-2-propoxy-1-(trifluoromethoxy)benzene |
| IUPAC Name | 4-bromo-2-propoxy-1-(trifluoromethoxy)benzene |
| InChI | InChI=1S/C10H10BrF3O2/c1-2-5-15-9-6-7(11)3-4-8(9)16-10(12,13)14/h3-4,6H,2,5H2,1H3 |
| InChI Key | SZERBABRIDBKBZ-UHFFFAOYSA-N |
| MDL Number | MFCD21333070 |
| Molecular Formula | C10H10BrF3O2 |
| Molecular Weight | 299.0844 |
| SMILES | CCCOc1cc(Br)ccc1OC(F)(F)F |
| Synonyms | 4-Bromo-2-propoxy-1-(trifluoromethoxy)benzene,
1355248-26-8,
ACMC-209c3m,
CTK8B0447,
DTXSID70742824,
ANW-19952,
MFCD21333070,
ZINC85476963,
TC-108697,
V2501,
K-4315,
C10H10BrF3O2,
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| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.982g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.087g/mol |
| Monoisotopic Mass | 297.982g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
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Certificate of Analysis
Lot Number