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Substance Name: Benz(a)anthracene, 9-isopropyl-
RN: 63020-48-4
InChIKey: PPSSWZLVDPGSQP-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C21-H18

Molecular Weight

  • 270.373
 
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Names and Synonyms

Synonyms

  • 3-05-00-02425 (Beilstein Handbook Reference)
  • 6-Isopropyl-1:2-benzanthracene
  • 9-Isopropylbenz(a)anthracene
  • BRN 2525192

Systematic Name

  • Benz(a)anthracene, 9-isopropyl-

Registry Numbers

CAS Registry Number

  • 63020-48-4

System Generated Number

  • 0063020484

Structure Descriptors

InChI

1S/C21H18/c1-14(2)16-8-9-17-13-21-18(12-19(17)11-16)10-7-15-5-3-4-6-20(15)21/h3-14H,1-2H3

InChIKey

PPSSWZLVDPGSQP-UHFFFAOYSA-N

Smiles

c12c3c(ccc1cc1cc(C(C)C)ccc1c2)cccc3