Benzo(a)pyren-3-ol, 7-methyl-
7-methylbenzo[a]pyren-3-ol
Also Known As: Benzo(a)pyren-3-ol, 7-methyl-|7-methylbenzo[a]pyren-3-ol|7-methylbenzo[pqr]tetraphen-3-ol
CAS: 79418-83-0
| Molecular Formula | C21H14O |
|---|---|
| Molecular Weight | 282.10446 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 282.10446 |
| Monoisotopic Mass | 282.10446 |
| Heavy Atoms | 22 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 79418-83-0 |
|---|---|
| SMILES | CC1=C2C=C3C=CC4=C(C=CC5=C4C3=C(C2=CC=C1)C=C5)O |
| InChIKey | SICNFFZLNVZEST-UHFFFAOYSA-N |
Product Overview
Benzo(a)pyren-3-ol, 7-methyl- (CAS 79418-83-0), with molecular formula C21H14O and molecular weight 282.10446 g/mol. IUPAC: 7-methylbenzo[a]pyren-3-ol.
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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