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1,6-Dinitropyrene Structure

1,6-Dinitropyrene

Chemical Properties

Melting point >300 °C(lit.)
Boiling point 434.19°C (rough estimate)
Density  1.2855 (rough estimate)
refractive index  1.5800 (estimate)
storage temp.  −20°C
Henry's Law Constant 7.6×104 mol/(m3Pa) at 25℃, HSDB (2015)
Stability Stable. Incompatible with strong oxidizing agents, strong bases.
InChI 1S/C16H8N2O4/c19-17(20)13-8-4-10-2-6-12-14(18(21)22)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H
InChIKey GUXACCKTQWVTLG-UHFFFAOYSA-N
SMILES [O-][N+](=O)c1ccc2ccc3c(ccc4ccc1c2c34)[N+]([O-])=O
IARC 2B (Vol. 46, 105) 2014
EPA Substance Registry System 1,6-Dinitropyrene (42397-64-8)

Safety Information

Hazard Codes  T
Risk Statements  45
Safety Statements  53-36
WGK Germany  3
RTECS  UR2455000
Storage Class 6.1D - Non-combustible acute toxic Cat.3
toxic hazardous materials or hazardous materials causing chronic effects
Hazard Classifications Carc. 1B
Hazardous Substances Data 42397-64-8(Hazardous Substances Data)

MSDS

Usage And Synthesis

1,6-Dinitropyrene Supplier