| CAS Number | 762292-69-3 |
| Catalog Number | AG01BJ1O(AGN-PC-03ZZTO) |
| Chemical Name | 1-(2-Bromo-1,1-difluoroethyl)-4-fluorobenzene |
| IUPAC Name | 1-(2-bromo-1,1-difluoroethyl)-4-fluorobenzene |
| InChI | InChI=1S/C8H6BrF3/c9-5-8(11,12)6-1-3-7(10)4-2-6/h1-4H,5H2 |
| InChI Key | BVIIGXXOEJRCEE-UHFFFAOYSA-N |
| MDL Number | MFCD07777121 |
| Molecular Formula | C8H6BrF3 |
| Molecular Weight | 239.0324 |
| SMILES | FC1=CC=C(C(CBr)(F)F)C=C1 |
| Synonyms | 1-(2-bromo-1,1-difluoroethyl)-4-fluorobenzene,
762292-69-3,
4-(2-Bromo-1,1-difluoroethyl)fluorobenzene,
SCHEMBL4785402,
CTK5I9552,
DTXSID10631465,
ZX-AP005314,
MFCD07777121,
PC2362,
SBB099025,
ZINC71790018,
AKOS025212927,
FCH1385415,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.035g/mol |
| Monoisotopic Mass | 237.96g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number