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Substance Name: Benzo(a)pyrene, 3-methyl-
RN: 16757-81-6
InChIKey: PIAGFISXZFTFAL-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C21-H14

Molecular Weight

  • 266.342
 
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Names and Synonyms

Synonyms

  • 3-Methylbenz(a)pyrene
  • 3-Methylbenzo(a)pyrene
  • 4-05-00-02694 (Beilstein Handbook Reference)
  • 8-Methyl-3,4-benzpyrene
  • BRN 3289723
  • CCRIS 2437

Systematic Names

  • 3-Methylbenzo(a)pyrene
  • Benzo(a)pyrene, 3-methyl-

Registry Numbers

CAS Registry Number

  • 16757-81-6

System Generated Number

  • 0016757816

Structure Descriptors

InChI

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

InChIKey

PIAGFISXZFTFAL-UHFFFAOYSA-N

Smiles

c12c3c4c(ccc3ccc1c1c(cccc1)cc2cc4)C