Benzo[a]pyrene 4,5-oxide
CAS Registry Number®
37574-47-3
CAS Name
Benzo[a]pyrene 4,5-oxideMolecular Formula
C20H12OMolecular Mass
268.31Cite this Page
Benzo[a]pyrene 4,5-oxide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=37574-47-3 (retrieved ) (CAS RN: 37574-47-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H12O/c1-2-6-13-12(4-1)10-16-18-14(13)9-8-11-5-3-7-15(17(11)18)19-20(16)21-19/h1-10,19-20H
InChIKey
InChIKey=XGZQLNASOQVQTD-UHFFFAOYSA-N
SMILES
C12=C3C=4C5C(C1=CC=6C(C2=CC=C3C=CC4)=CC=CC6)O5
Canonical SMILES
O1C2C=3C=CC=C4C=CC=5C=6C=CC=CC6C=C(C5C43)C12
Other Names for this Substance
- Benzo[1,2]pyreno[4,5-b]oxirene, 3b,4a-dihydro-
- 3b,4a-Dihydrobenzo[1,2]pyreno[4,5-b]oxirene
- Benzo[a]pyrene 4,5-oxide
- Benzo[a]pyrene 4,5-epoxide
- Benzopyrene 4,5-epoxide
Deleted or Replaced CAS Registry Numbers
64437-52-1