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Substance Name: 2,6-Pyridinediamine, 3,5-dinitro-N2,N6-bis(2,4,6-trinitrophenyl)-
RN: 38082-89-2
InChIKey: YSSXHRVRZWIAKV-UHFFFAOYSA-N

Classification Codes

  • Skin / Eye Irritant
  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C17-H7-N11-O16

Molecular Weight

  • 621.3033
 
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Names and Synonyms

Synonyms

  • 2,6-Bis(picrylamino)-3,5-dinitropyridine
  • 3,5-Dinitro-N,N'-bis(2,4,6-trinitrophenyl)-2,6-pyridinediamine
  • BRN 0471067
  • PYX
  • PYX explosive

Systematic Names

  • 2,6-Pyridinediamine, 3,5-dinitro-N,N'-bis(2,4,6-trinitrophenyl)-
  • 2,6-Pyridinediamine, 3,5-dinitro-N2,N6-bis(2,4,6-trinitrophenyl)-

Registry Numbers

CAS Registry Number

  • 38082-89-2

Other Registry Number

  • 57158-12-0

System Generated Number

  • 0038082892

Structure Descriptors

InChI

1S/C17H7N11O16/c29-21(30)6-1-8(23(33)34)14(9(2-6)24(35)36)18-16-12(27(41)42)5-13(28(43)44)17(20-16)19-15-10(25(37)38)3-7(22(31)32)4-11(15)26(39)40/h1-5H,(H2,18,19,20)

InChIKey

YSSXHRVRZWIAKV-UHFFFAOYSA-N

Smiles

c1(c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1c([N+](=O)[O-])cc(c(n1)Nc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   National Technical Information Service. Vol. LA-8695-MS,
rat LD50 oral > 5gm/kg (5000mg/kg)   National Technical Information Service. Vol. LA-8695-MS,