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Substance Name: Benz(a)anthracene, 12-ethyl-7-methyl-
RN: 16354-55-5
InChIKey: FTMBVQWARWOALX-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C21-H18

Molecular Weight

  • 270.373
 
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Names and Synonyms

Synonyms

  • 12-Ethyl-7-methylbenz(a)anthracene
  • 3-05-00-02426 (Beilstein Handbook Reference)
  • BRN 3054830
  • CCRIS 1536

Systematic Names

  • 7-Methyl-12-ethylbenz(a)anthracene
  • Benz(a)anthracene, 12-ethyl-7-methyl-

Registry Numbers

CAS Registry Number

  • 16354-55-5

System Generated Number

  • 0016354555

Structure Descriptors

InChI

1S/C21H18/c1-3-16-20-11-7-6-9-17(20)14(2)18-13-12-15-8-4-5-10-19(15)21(16)18/h4-13H,3H2,1-2H3

InChIKey

FTMBVQWARWOALX-UHFFFAOYSA-N

Smiles

c12c(c(C)c3c(c1CC)cccc3)ccc1c2cccc1