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Substance Name: Benz(a)anthracene, 8,9-dihydro-8,9-dihydroxy-10,11-epoxy-
RN: 100700-14-9
InChIKey: IEJALZPVWUCOSK-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C18-H14-O3

Molecular Weight

  • 276.2898
 
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Names and Synonyms

Synonyms

  • 8,9-Dihydro-8,9-dihydroxybenz(a)anthracene 10,11-oxide
  • 8,9-Dihydroxy-10,11-epoxy-8,9-dihydrobenz(a)anthracene

Systematic Name

  • Benz(a)anthracene, 8,9-dihydro-8,9-dihydroxy-10,11-epoxy-

Registry Numbers

CAS Registry Number

  • 100700-14-9

System Generated Number

  • 0100700149

Structure Descriptors

InChI

1S/C18H12O3/c19-15-13-7-10-6-5-9-3-1-2-4-11(9)12(10)8-14(13)17-18(21-17)16(15)20/h1-8,15-16,19-20H

InChIKey

IEJALZPVWUCOSK-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)ccc3c2cc4c(c3)C(C(C5=C4O5)O)O