| CAS Number | 1261629-20-2 |
| Catalog Number | AG01FEMA(AGN-PC-3H4A2E) |
| Chemical Name | 1-Chloro-4,5-difluoro-2-iodobenzene |
| IUPAC Name | 1-chloro-4,5-difluoro-2-iodobenzene |
| InChI | InChI=1S/C6H2ClF2I/c7-3-1-4(8)5(9)2-6(3)10/h1-2H |
| InChI Key | VCOUCZFUPYEBRY-UHFFFAOYSA-N |
| MDL Number | MFCD18415601 |
| Molecular Formula | C6H2ClF2I |
| Molecular Weight | 274.4344 |
| SMILES | Fc1cc(I)c(cc1F)Cl |
| Synonyms | 2-Chloro-4,5-difluoroiodobenzene,
1261629-20-2,
1-chloro-4,5-difluoro-2-iodobenzene,
ZINC79387454,
AKOS027346462,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.886g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.433g/mol |
| Monoisotopic Mass | 273.886g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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Certificate of Analysis
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