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Substance Name: Benz(a)anthracene-3,4-diol, 3,4-dihydro-7-chloro-, trans-
RN: 134109-03-8
InChIKey: SCMDZPRUOBLVPI-WMZOPIPTSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C18-H13-Cl-O2

Molecular Weight

  • 296.752
 
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Names and Synonyms

Synonyms

  • 7-Chlorobenz(a)anthracene-trans-3,4-dihydrodiol
  • CCRIS 3879
  • trans-3,4-Dihydroxy-3,4-dihydro-7-chlorobenz(a)anthracene

Systematic Names

  • 7-Chlorobenz(a)anthracene 3,4-dihydrodiol
  • Benz(a)anthracene-3,4-diol, 3,4-dihydro-7-chloro-, trans-

Registry Numbers

CAS Registry Number

  • 134109-03-8

System Generated Number

  • 0134109038

Structure Descriptors

InChI

1S/C18H13ClO2/c19-17-11-4-2-1-3-10(11)9-15-12-7-8-16(20)18(21)14(12)6-5-13(15)17/h1-9,16,18,20-21H/t16-,18-/m0/s1

InChIKey

SCMDZPRUOBLVPI-WMZOPIPTSA-N

Smiles

c12c(ccc3c(c4ccccc4cc13)Cl)[C@@H]([C@H](C=C2)O)O