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Substance Name: 3-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene
RN: 88598-57-6
InChIKey: GMGGMXJWIUFFNB-UHFFFAOYSA-N

Note

  • Used in producing N(2)-deoxyguanosinyl adducts of benzo(a)pyrene.

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H15-N-O2

Molecular Weight

  • 301.344
 
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Names and Synonyms

Name of Substance

  • 3-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene

Synonyms

  • 3-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene
  • 7,8,9,10-Tetrahydro-3-nitrobenzo(a)pyrene
  • BRN 6226549
  • CCRIS 5870

Systematic Names

  • 3-Nitro-7,8,9,10-tetrahydrobenzo(a)pyrene
  • Benzo(a)pyrene, 7,8,9,10-tetrahydro-3-nitro-

Registry Numbers

CAS Registry Number

  • 88598-57-6

System Generated Number

  • 0088598576

Structure Descriptors

InChI

1S/C20H15NO2/c22-21(23)18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h5-11H,1-4H2

InChIKey

GMGGMXJWIUFFNB-UHFFFAOYSA-N

Smiles

c12c3c4c(ccc3ccc1c1c(CCCC1)cc2cc4)[N+](=O)[O-]