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Substance Name: Benz(a)anthracene, 8,9-dimethyl-
RN: 58430-00-5
InChIKey: PYYMVIMLYZWIHJ-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C20-H16

Molecular Weight

  • 256.346
 
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Names and Synonyms

Synonyms

  • 3-05-00-02414 (Beilstein Handbook Reference)
  • 5,6-Dimethyl-1,2-benzanthracene
  • 8,9-Dimethylbenz(a)anthracene
  • BRN 3261103

Systematic Name

  • Benz(a)anthracene, 8,9-dimethyl-

Registry Numbers

CAS Registry Number

  • 58430-00-5

System Generated Number

  • 0058430005

Structure Descriptors

InChI

1S/C20H16/c1-13-7-8-16-12-20-17(11-19(16)14(13)2)10-9-15-5-3-4-6-18(15)20/h3-12H,1-2H3

InChIKey

PYYMVIMLYZWIHJ-UHFFFAOYSA-N

Smiles

c12c3c(ccc1cc1c(c(C)ccc1c2)C)cccc3