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Substance Name: Benz(a)anthracene, 7-(iodomethyl)-12-methyl-
RN: 27018-50-4
InChIKey: YCEFXAWNLQFCMH-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C20-H15-I

Molecular Weight

  • 382.238
 
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Names and Synonyms

Synonyms

  • 3-05-00-02414 (Beilstein Handbook Reference)
  • 7-Iodomethyl-12-methylbenz(a)anthracene
  • BRN 3343061

Systematic Name

  • Benz(a)anthracene, 7-(iodomethyl)-12-methyl-

Registry Numbers

CAS Registry Number

  • 27018-50-4

System Generated Number

  • 0027018504

Structure Descriptors

InChI

1S/C20H15I/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16(14)20(13)18/h2-11H,12H2,1H3

InChIKey

YCEFXAWNLQFCMH-UHFFFAOYSA-N

Smiles

c12c(c(CI)c3c(c1C)cccc3)ccc1c2cccc1