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Substance Name: 6-Nitrobenzo(a)pyrene
RN: 63041-90-7
InChIKey: NMMAFYSZGOFZCM-UHFFFAOYSA-N

Molecular Formula

  • C20-H11-N-O2

Molecular Weight

  • 297.312
 

Classification Codes

Classification Codes

  • Carcinogens
  • Mutagens
  • Mutation Data
  • Noxae
  • Tumor Data

Superlist Classification Code

  • Overall Carcinogenic Evaluation: Group 3
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Names and Synonyms

Name of Substance

  • 6-Nitrobenzo(a)pyrene

Synonyms

  • 4-05-00-02689 (Beilstein Handbook Reference)
  • 6-Nitrobenz(a)pyrene
  • 6-Nitrobenzo(a)pyrene
  • BRN 2472924
  • CCRIS 2434
  • HSDB 5752
  • HSDB 8186

Systematic Names

  • 6-Nitrobenzo(a)pyrene
  • Benzo(a)pyrene, 6-nitro-

Superlist Name

  • 6-Nitrobenzo(a)pyrene

Registry Numbers

CAS Registry Number

  • 63041-90-7

System Generated Number

  • 0063041907

Structure Descriptors

InChI

1S/C20H11NO2/c22-21(23)20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H

InChIKey

NMMAFYSZGOFZCM-UHFFFAOYSA-N

Smiles

c12c3c4ccc1c1c(cccc1)c(c2ccc3ccc4)[N+](=O)[O-]