| CAS Number | 1432681-62-3 |
| Catalog Number | AG01A524 |
| Chemical Name | 5-bromo-2-(difluoromethoxy)-3-methylbenzaldehyde |
| IUPAC Name | 5-bromo-2-(difluoromethoxy)-3-methylbenzaldehyde |
| InChI | InChI=1S/C9H7BrF2O2/c1-5-2-7(10)3-6(4-13)8(5)14-9(11)12/h2-4,9H,1H3 |
| InChI Key | ZPZKVZNINXLDPX-UHFFFAOYSA-N |
| MDL Number | MFCD24369212 |
| Molecular Formula | C9H7BrF2O2 |
| Molecular Weight | 265.0515 |
| SMILES | CC1=C(OC(F)F)C(C=O)=CC(Br)=C1 |
| Synonyms | 5-bromo-2-(difluoromethoxy)-3-methylbenzaldehyde,
1432681-62-3,
ZINC95218402,
NE25472,
|
| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.054g/mol |
| Monoisotopic Mass | 263.96g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number