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Substance Name: Benzo(a)pyrene, 11-methyl-
RN: 16757-80-5
InChIKey: ZWJRHJOLMBZEMI-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C21-H14

Molecular Weight

  • 266.342
 
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Names and Synonyms

Synonyms

  • 11-Methylbenzo(a)pyrene
  • 4-05-00-02695 (Beilstein Handbook Reference)
  • 6-Methyl-3,4-benzpyrene
  • BRN 2109259
  • CCRIS 2444

Systematic Names

  • 11-Methylbenzo(a)pyrene
  • Benzo(a)pyrene, 11-methyl-

Registry Numbers

CAS Registry Number

  • 16757-80-5

System Generated Number

  • 0016757805

Structure Descriptors

InChI

1S/C21H14/c1-13-11-16-7-4-6-14-9-10-17-12-15-5-2-3-8-18(15)19(13)21(17)20(14)16/h2-12H,1H3

InChIKey

ZWJRHJOLMBZEMI-UHFFFAOYSA-N

Smiles

c12c3c4cc(c1c1c(cccc1)cc2ccc3ccc4)C