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1,8-Dihydroxy-4,5-dinitroanthraquinone Structure

1,8-Dihydroxy-4,5-dinitroanthraquinone

Chemical Properties

Melting point 225 °C (dec.) (lit.)
Boiling point 467.67°C (rough estimate)
Density  1.4944 (rough estimate)
refractive index  1.5910 (estimate)
storage temp.  -20°C Freezer
solubility  Dichloromethane (Very Slightly, Heated, Sonicated), DMSO (Slightly)
form  Solid
pka 3.45±0.20(Predicted)
color  Brown
Stability Stable. Incompatible with strong oxidizing agents.
InChI InChI=1S/C14H6N2O8/c17-7-3-1-5(15(21)22)9-11(7)14(20)12-8(18)4-2-6(16(23)24)10(12)13(9)19/h1-4,17-18H
InChIKey GJCHQJDEYFYWER-UHFFFAOYSA-N
SMILES C1(O)=C2C(C(=O)C3=C(C2=O)C(O)=CC=C3[N+]([O-])=O)=C([N+]([O-])=O)C=C1
CAS DataBase Reference 81-55-0(CAS DataBase Reference)
FDA UNII HEO6302D6D
NIST Chemistry Reference Anthraquinone, 1,8-dihydroxy-4,5-dinitro-,(81-55-0)
EPA Substance Registry System 1,8-Dihydroxy-4,5-dinitroanthraquinone (81-55-0)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
RTECS  CB6700000
TSCA  Yes
HS Code  29147000
NFPA 704:
0
0 0

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