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54078-29-4

Name 1,8-Diazafluoran-9-one
CAS 54078-29-4
Molecular Formula C11H6N2O
MDL Number MFCD00082335
Molecular Weight 182.18
MOL File 54078-29-4.mol
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Chemical Properties

Appearance yellow powder
Melting point  229-233 °C
Boiling point  396.3±17.0 °C(Predicted)
density  1.387±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  acetic acid: 10 mg/mL, clear
form  Solid
pka 0.69±0.20(Predicted)
color  Light yellow to yellow
Stability: Stable. Incompatible with strong oxidizing agents.
BRN  134499
InChI InChI=1S/C11H6N2O/c14-11-9-7(3-1-5-12-9)8-4-2-6-13-10(8)11/h1-6H
InChIKey FOSUVSBKUIWVKI-UHFFFAOYSA-N
SMILES C12C(=O)C3=NC=CC=C3C1=CC=CN=2
CAS DataBase Reference 54078-29-4

Safety Data

Hazard Codes  Xi
Safety Statements 
WGK Germany  3
F  10
HS Code  29339900

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