| CAS Number | 295803-26-8 |
| Catalog Number | AG002YSZ(AGN-PC-01MCZB) |
| Chemical Name | 4-bromo-1-(dibromomethyl)-2-fluorobenzene |
| EC Number | 608-377-9 |
| IUPAC Name | 4-bromo-1-(dibromomethyl)-2-fluorobenzene |
| InChI | InChI=1S/C7H4Br3F/c8-4-1-2-5(7(9)10)6(11)3-4/h1-3,7H |
| InChI Key | IWJXZHAXIPORHB-UHFFFAOYSA-N |
| MDL Number | MFCD29059075 |
| Molecular Formula | C7H4Br3F |
| Molecular Weight | 346.8171 |
| SMILES | Fc1cc(Br)ccc1C(Br)Br |
| Synonyms | 4-bromo-1-(dibromomethyl)-2-fluorobenzene,
295803-26-8,
Benzene, 4-bromo-1-(dibromomethyl)-2-fluoro-,
4-bromo-2-fluorobenzal bromide,
SCHEMBL3872105,
KS-000001OR,
MFCD29059075,
AKOS028109917,
ZINC140124175,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 345.783g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 346.819g/mol |
| Monoisotopic Mass | 343.785g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
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Certificate of Analysis
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