6-(Bromomethyl-13C)benzo(a)pyrene
6-(bromo(113C)methyl)benzo[a]pyrene
Also Known As: 6-Bromomethylbenzo(a)pyrene|6-(bromomethyl)benzo[a]pyrene|6-(Bromomethyl-13C)benzo(a)pyrene|Benzo(a)pyrene, 6-(bromomethyl-13C)-|6-[Bromo(~13~C)methyl]benzo[pqr]tetraphene
CAS: 70682-35-8
| Molecular Formula | C21H13Br |
|---|---|
| Molecular Weight | 345.0234 g/mol |
| LogP | 6.8 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 345.0234 |
| Monoisotopic Mass | 345.0234 |
| Heavy Atoms | 22 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 70682-35-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=C2[13CH2]Br)C=CC5=CC=CC(=C54)C=C3 |
| InChIKey | DMAOOKLAQXNHTK-HNHCFKFXSA-N |
Product Overview
6-(Bromomethyl-13C)benzo(a)pyrene (CAS 70682-35-8), with molecular formula C21H13Br and molecular weight 345.0234 g/mol. IUPAC: 6-(bromo(113C)methyl)benzo[a]pyrene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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