3,4-Dihydroxy-1,2-epoxy 1,2,3,4-tetrahydrodibenzo(a,e)fluoranthene
20-oxaheptacyclo[14.8.1.02,7.08,25.010,15.018,24.019,21]pentacosa-1(25),2,4,6,8,10,12,14,16,18(24)-decaene-22,23-diol
Also Known As: 3,4-DET-DBF|Sid 711134|3,4-Dihydroxy-1,2-epoxy 1,2,3,4-tetrahydrodibenzo(a,e)fluoranthene|Dibenzo(a,e)fluoranthene-1,2-epoxy-1,2,3,4-tetrahydro-3,4-diol|1a,2,3,13b-tetrahydroindeno[1',2',3':6,7]tetrapheno[10,11-b]oxirene-2,3-diol|3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenzo(a,e)fluoranthene|20-oxaheptacyclo[14.8.1.02,7.08,25.010,15.018,24.019,21]pentacosa-1(25),2,4,6,8,10,12,14,16,18(24)-decaene-22,23-diol|Dibenz(2,3:4,5)acephenanthryleno(9,10-b)oxirene-7,8-diol, 5c,6a,7,8-tetrahydro-, (5c-alpha,6a-alpha,7-beta,8-alpha)-|Dibenz(2,3:4,5)acephenanthryleno(9,10-b)oxirene-7,8-diol, 5c,6a,7,8-tetrahydro-, (5calpha,6aalpha,7beta,8alpha)-
| Molecular Formula | C24H16O3 |
|---|---|
| Molecular Weight | 352.10995 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 352.10995 |
| Monoisotopic Mass | 352.10995 |
| Heavy Atoms | 27 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 91092-19-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C5=C3C2=CC6=C5C(C(C7C6O7)O)O |
| InChIKey | UXERMJWUEOEVIA-UHFFFAOYSA-N |
Product Overview
3,4-Dihydroxy-1,2-epoxy 1,2,3,4-tetrahydrodibenzo(a,e)fluoranthene (CAS 91092-19-2), with molecular formula C24H16O3 and molecular weight 352.10995 g/mol. IUPAC: 20-oxaheptacyclo[14.8.1.02,7.08,25.010,15.018,24.019,21]pentacosa-1(25),2,4,6,8,10,12,14,16,18(24)-decaene-22,23-diol.