| CAS Number | 1261679-30-4 |
| Catalog Number | AG01B7KD |
| Chemical Name | 1-Bromo-4-(difluoromethoxy)-2-methoxybenzene |
| IUPAC Name | 1-bromo-4-(difluoromethoxy)-2-methoxybenzene |
| InChI | InChI=1S/C8H7BrF2O2/c1-12-7-4-5(13-8(10)11)2-3-6(7)9/h2-4,8H,1H3 |
| InChI Key | KPUZODUHXYIKJD-UHFFFAOYSA-N |
| MDL Number | MFCD18390865 |
| Molecular Formula | C8H7BrF2O2 |
| Molecular Weight | 253.0408 |
| SMILES | COC1=C(Br)C=CC(OC(F)F)=C1 |
| Synonyms | 1-Bromo-4-(difluoromethoxy)-2-methoxybenzene,
1261679-30-4,
SCHEMBL20562225,
2-Bromo-5-(difluoromethoxy)anisole,
AKOS027377139,
ZINC170641256,
Z1992316268,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.043g/mol |
| Monoisotopic Mass | 251.96g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number