| CAS Number | 1428234-81-4 |
| Catalog Number | AG01BXFX |
| Chemical Name | 2-Bromo-6-Fluoro-3-(Trifluoromethyl)Benzaldehyde |
| IUPAC Name | 2-bromo-6-fluoro-3-(trifluoromethyl)benzaldehyde |
| InChI | InChI=1S/C8H3BrF4O/c9-7-4(3-14)6(10)2-1-5(7)8(11,12)13/h1-3H |
| InChI Key | RCOWGTKGKUWTDH-UHFFFAOYSA-N |
| MDL Number | MFCD23713146 |
| Molecular Formula | C8H3BrF4O |
| Molecular Weight | 271.0064 |
| SMILES | O=CC1=C(F)C=CC(C(F)(F)F)=C1Br |
| Synonyms | 2-Bromo-6-fluoro-3-(trifluoromethyl)benzaldehyde,
1428234-81-4,
MFCD23713146,
ZINC90413695,
AKOS027425590,
Z1316,
Q-8606,
C8H3BrF4O,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.93g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.009g/mol |
| Monoisotopic Mass | 269.93g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number