ChemicalBook--->CAS DataBase List--->55097-80-8

55097-80-8

55097-80-8 Structure

55097-80-8 Structure
IdentificationBack Directory
[Name]

7,8-Dihydro-7,8-dihydroxybenzo(a)pyrene 9,10-oxide
[CAS]

55097-80-8
[Synonyms]

Benzopyrene Related Compound 10
7,8-Dihydro-7,8-dihydroxybenzo(a)pyrene 9,10-oxide
7,8,9,10-Tetrahydro-7,8-dihydroxybenzo[a]pyrene 9,10-epoxide
Benzo[10,11]chryseno[3,4-b]oxirene-7,8-diol, 7,8,8a,9a-tetrahydro-
[Molecular Formula]

C20H14O3
[MDL Number]

MFCD00871186
[MOL File]

55097-80-8.mol
[Molecular Weight]

302.32
Chemical PropertiesBack Directory
[Boiling point ]

594.2±50.0 °C(Predicted)
[density ]

1.569
[pka]

13.50±0.40(Predicted)
[InChI]

InChI=1S/C20H14O3/c21-17-13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)19-20(23-19)18(17)22/h1-8,17-22H
[InChIKey]

DQEPMTIXHXSFOR-UHFFFAOYSA-N
[SMILES]

O1C2C3=C(C(O)C(O)C12)C=C1C=CC2=C4C1=C3C=CC4=CC=C2
Hazard InformationBack Directory
[Definition]

ChEBI: Benzo[a]pyrene diol epoxide I is an epoxide. It has a role as an intercalator. It derives from a hydride of a benzo[a]pyrene.
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