BENZO(a)PYRENE, 6-BENZOYLOXYMETHYL-
benzo[b]pyren-6-ylmethyl benzoate
Also Known As: 6-Benzoyloxymethylbenzo(a)pyrene|BRN 2483705|AC1L21L4|BENZO(a)PYRENE, 6-BENZOYLOXYMETHYL-|CTK4I6857|6-BENZOYLOXYMETHYLBENZO[A]PYRENE|6-BENZOYLOXYMETHYLBENZO PYRENE|benzo[a]pyren-6-ylmethyl benzoate|benzo[b]pyren-6-ylmethyl benzoate|Benzo[a]pyrene-6-methanol, benzoate|(Benzo[pqr]tetraphen-6-yl)methyl benzoate
| Molecular Formula | C28H18O2 |
|---|---|
| Molecular Weight | 386.13068 g/mol |
| LogP | 7.09 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.13068 |
| Heavy Atoms | 30 |
| Complexity | 1531.9 |
Chemical Identifiers
| CAS Number | 42978-42-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62 |
Product Overview
BENZO(a)PYRENE, 6-BENZOYLOXYMETHYL- (CAS 42978-42-7), with molecular formula C28H18O2 and molecular weight 386.13068 g/mol. IUPAC: benzo[b]pyren-6-ylmethyl benzoate.
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