| CAS Number | 1231747-49-1 |
| Catalog Number | AG00HH6M(AGN-PC-0WNO9H) |
| Chemical Name | 2-Fluoro-6-iodobenzyl bromide |
| IUPAC Name | 2-(bromomethyl)-1-fluoro-3-iodobenzene |
| InChI | InChI=1S/C7H5BrFI/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2 |
| InChI Key | RFRFLWHSLPODFE-UHFFFAOYSA-N |
| MDL Number | MFCD18396957 |
| Molecular Formula | C7H5BrFI |
| Molecular Weight | 314.9215 |
| SMILES | C1=CC(=C(C(=C1)I)CBr)F |
| Synonyms | 2-Fluoro-6-iodobenzyl bromide,
1231747-49-1,
2-(BROMOMETHYL)-1-FLUORO-3-IODOBENZENE,
SCHEMBL15538358,
ZX-AP009477,
MFCD18396957,
ZINC95917621,
FCH1371822,
PC32721,
AK680410,
PS-10029,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 313.86g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 314.924g/mol |
| Monoisotopic Mass | 313.86g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
Lot Number