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Substance Name: Cholanthrene, 9-fluoro-3-methyl-
RN: 73771-74-1
InChIKey: DWAAPINKQXPQPD-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C21-H15-F

Molecular Weight

  • 286.3475
 
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Names and Synonyms

Synonyms

  • 9-Fluoro-3-methylcholanthrene
  • Benz(j)aceanthrylene, 1,2-dihydro-9-fluoro-3-methyl-

Systematic Name

  • Cholanthrene, 9-fluoro-3-methyl-

Registry Numbers

CAS Registry Number

  • 73771-74-1

System Generated Number

  • 0073771741

Structure Descriptors

InChI

1S/C21H15F/c1-12-2-3-14-11-20-17-7-5-15(22)10-13(17)4-6-18(20)19-9-8-16(12)21(14)19/h2-7,10-11H,8-9H2,1H3

InChIKey

DWAAPINKQXPQPD-UHFFFAOYSA-N

Smiles

Cc1ccc2cc3c4ccc(cc4ccc3c5c2c1CC5)F