1,3,6-Trinitropyrene

CAS Registry Number®

75321-19-6

CAS Name

1,3,6-Trinitropyrene

Molecular Formula

C16H7N3O6

Molecular Mass

337.24

Cite this Page

1,3,6-Trinitropyrene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=75321-19-6 (retrieved 2024-12-22) (CAS RN: 75321-19-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H7N3O6/c20-17(21)12-6-2-8-1-3-10-13(18(22)23)7-14(19(24)25)11-5-4-9(12)15(8)16(10)11/h1-7H

InChIKey

InChIKey=BXOXVTWMJCUYLW-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C2C3=C4C(=C(N(=O)=O)C=CC4=CC=C3C(N(=O)=O)=C1)C=C2

Canonical SMILES

O=N(=O)C=1C=CC2=CC=C3C(=CC(=C4C=CC1C2=C34)N(=O)=O)N(=O)=O

Other Names for this Substance

  • Pyrene, 1,3,6-trinitro-
  • 1,3,6-Trinitropyrene

CAS INSIGHTSTM
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