7,8-Epoxy-7,8,9,10-tetrahydrobenzo(a)pyrene
6-oxahexacyclo[11.6.2.02,8.05,7.010,20.017,21]henicosa-1(20),2(8),9,11,13(21),14,16,18-octaene
Also Known As: AC1L1XRK|9,10-Dihydrobenzo(a)pyrene-7,8-epoxide|CTK3I9125|7,8,9,10-Tetrahydro-BP-7,8-oxide|7,8-Epoxy-7,8,9,10-tetrahydrobenzo(a)pyrene|Ammonium 7-hydroxynaphthalenesulphonate|J1.692.030D|BENZO(a)PYRENE, 7,8,9,10-TETRAHYDRO-7,8-EPOXY-|7,8-Epoxy-7,8,9,10-tetrahydrobenzo[a]pyrene|7,8-EPOXY-7,8,9,10-TETRAHYDROBENZO(a)-PYRENE|6b,7a,8,9-Tetrahydrobenzo(10,11)chryseno(1,2-b)oxirene cis-(+-)-|6b,7a,8,9-tetrahydrobenzo[1,12]tetrapheno[8,9-b]oxirene|Benzo(10,11)chryseno(1,2-b)oxirene, 6b,7a,8,9-tetrahydro-, cis-(+-)-|Benzo[10,11]chryseno[1,2-b]oxirene, 6b,7a,8,9-tetrahydro-|6-oxahexacyclo[11.6.2.02,8.05,7.010,20.017,21]henicosa-1(19),2(8),9,11,13,15,17,20-octaene
| Molecular Formula | C20H14O |
|---|---|
| Molecular Weight | 270.10446 g/mol |
| LogP | 4.97 |
| Topological Polar Surface Area | 12.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.10446 |
| Heavy Atoms | 21 |
| Complexity | 1014.5 |
Chemical Identifiers
| CAS Number | 36504-67-3 |
|---|---|
| SMILES | C1CC2=C(C=C3C=CC4=C5C3=C2C=CC5=CC=C4)C6C1O6 |
Product Overview
7,8-Epoxy-7,8,9,10-tetrahydrobenzo(a)pyrene (CAS 36504-67-3), with molecular formula C20H14O and molecular weight 270.10446 g/mol. IUPAC: 6-oxahexacyclo[11.6.2.02,8.05,7.010,20.017,21]henicosa-1(20),2(8),9,11,13(21),14,16,18-octaene.
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