3b,4a-Dihydrobenzo[12,1]benz[a]anthra[5,6-b]oxiren-8-ol

CAS Registry Number®

61133-85-5
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CAS Name

3b,4a-Dihydrobenzo[12,1]benz[a]anthra[5,6-b]oxiren-8-ol

Molecular Formula

C20H12O2

Molecular Mass

284.31

Cite this Page

3b,4a-Dihydrobenzo[12,1]benz[a]anthra[5,6-b]oxiren-8-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61133-85-5 (retrieved 2024-09-19) (CAS RN: 61133-85-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H12O2/c21-12-6-4-11-8-16-18-13(15(11)9-12)7-5-10-2-1-3-14(17(10)18)19-20(16)22-19/h1-9,19-21H

InChIKey

InChIKey=QMJJLPWCBGOGAF-UHFFFAOYSA-N

SMILES

OC=1C=C2C=3C4=C5C(C6C(C4=CC2=CC1)O6)=CC=CC5=CC3

Canonical SMILES

OC=1C=CC2=CC3=C4C(C=CC5=CC=CC(=C54)C6OC36)=C2C1

Other Names for this Substance

  • Benzo[12,1]benz[a]anthra[5,6-b]oxiren-8-ol, 3b,4a-dihydro-
  • Benzo[1,2]pyreno[4,5-b]oxiren-8-ol, 3b,4a-dihydro-
  • 3b,4a-Dihydrobenzo[12,1]benz[a]anthra[5,6-b]oxiren-8-ol
  • 9-Hydroxybenzo[a]pyrene-4,5-oxide

Deleted or Replaced CAS Registry Numbers

97614-58-9