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Substance Name: Benzo(a)pyrene, 6-methoxy-
RN: 52351-96-9
InChIKey: OSXVWSFKNYMAPX-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C21-H14-O

Molecular Weight

  • 282.341
 
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Names and Synonyms

Synonyms

  • 3-06-00-03810 (Beilstein Handbook Reference)
  • 6-Methoxybenzo(a)pyrene
  • BRN 2468269

Systematic Name

  • Benzo(a)pyrene, 6-methoxy-

Registry Numbers

CAS Registry Number

  • 52351-96-9

System Generated Number

  • 0052351969

Structure Descriptors

InChI

1S/C21H14O/c1-22-21-17-8-3-2-7-15(17)16-11-9-13-5-4-6-14-10-12-18(21)20(16)19(13)14/h2-12H,1H3

InChIKey

OSXVWSFKNYMAPX-UHFFFAOYSA-N

Smiles

c12c3c4ccc1c1c(cccc1)c(c2ccc3ccc4)OC