3-Aminobenzo(a)pyrene
benzo[a]pyren-3-amine
Also Known As: 3-Aminobenzo(a)pyrene|Benzo(a)pyren-3-amine|3-aminobenzo pyrene|benzo[a]pyren-3-amine|Benzo(a)pyrene, 3-amino-|benzo[pqr]tetraphen-3-amine|Benzo[a]pyrene, 8-amino|3-ABaP|3-AMINOBENZO[A]PYRENE
CAS: 5465-05-4
| Molecular Formula | C20H13N |
|---|---|
| Molecular Weight | 267.1048 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.1048 |
| Monoisotopic Mass | 267.1048 |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 5465-05-4 |
|---|---|
| SMILES | C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)N |
| InChIKey | QBWLAIGPKULPQC-UHFFFAOYSA-N |
Product Overview
3-Aminobenzo(a)pyrene (CAS 5465-05-4), with molecular formula C20H13N and molecular weight 267.1048 g/mol. IUPAC: benzo[a]pyren-3-amine.
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.
View MSDS →
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