Bromobenzene extrapure AR, 99%
Chemical Information
Bromobenzene is the simplest member of the class of bromobenzenes, that is benzene in which a single hydrogen has been substituted by a bromine. A liquid at room temperature (m.p. 30C; b.p.760 156C), it is used as a solvent, particularly for large-scale crystallisations, and for the introduction of phenyl groups in organic synthesis. It has a role as a non-polar solvent, a hepatotoxic agent and a mouse metabolite. It is a volatile organic compound, a bromoarene and a member of bromobenzenes.
| CAS Number | 108-86-1 |
| PubChem CID | 7961 |
| IUPAC Name | bromobenzene |
| Molecular Formula | C6H5Br |
| Molecular Weight | 157.01 |
| XLogP | 3 |
| Topological Polar Surface Area | 0 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 46 |
| Property | Value |
|---|---|
| Molecular Weight | 157.01 |
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 155.95746 |
| Monoisotopic Mass | 155.95746 |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 46.1 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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