| CAS Number | 946605-55-6 |
| Catalog Number | AG00IIFC |
| Chemical Name | 1-Bromo-2-(2,2-difluoroethoxy)benzene |
| IUPAC Name | 1-bromo-2-(2,2-difluoroethoxy)benzene |
| InChI | InChI=1S/C8H7BrF2O/c9-6-3-1-2-4-7(6)12-5-8(10)11/h1-4,8H,5H2 |
| InChI Key | STMKNINOKNUOGI-UHFFFAOYSA-N |
| MDL Number | MFCD11036116 |
| Molecular Formula | C8H7BrF2O |
| Molecular Weight | 237.0414 |
| SMILES | FC(F)COC1=CC=CC=C1Br |
| Synonyms | 1-bromo-2-(2,2-difluoroethoxy)benzene,
946605-55-6,
1-BROMO-2-(2,2-DIFLUORO-ETHOXY)-BENZENE,
CTK5H6934,
DTXSID60669713,
MFCD11036116,
ZINC37756007,
2-(2,2-difluoroethoxy)phenyl bromide,
AKOS010145248,
MCULE-7302851672,
NE51949,
Benzene, 1-bromo-2-(2,2-difluoroethoxy)-,
Z1623924794,
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| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.044g/mol |
| Monoisotopic Mass | 235.965g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number