| CAS Number | 1261614-16-7 |
| Catalog Number | AG01BI8B |
| Chemical Name | 1-bromo-2-chloro-4-(difluoromethyl)benzene |
| IUPAC Name | 1-bromo-2-chloro-4-(difluoromethyl)benzene |
| InChI | InChI=1S/C7H4BrClF2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,7H |
| InChI Key | FZWYGWWGQSFDLZ-UHFFFAOYSA-N |
| MDL Number | MFCD18391079 |
| Molecular Formula | C7H4BrClF2 |
| Molecular Weight | 241.4605 |
| SMILES | FC(C1=CC(Cl)=C(Br)C=C1)F |
| Synonyms | 1-Bromo-2-chloro-4-(difluoromethyl)benzene,
1261614-16-7,
SCHEMBL2522805,
DTXSID50719190,
ZINC79387269,
AKOS023601056,
FS-5588,
2-Bromo-5-(difluoromethyl)chlorobenzene,
Benzene,1-bromo-2-chloro-4-(difluoromethyl)-,
1-Bromo-2-chloro-4-(difluoromethyl)benzene stabilized over potassium carbonate,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.915g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.46g/mol |
| Monoisotopic Mass | 239.915g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number