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6-Nitroindazole Structure

6-Nitroindazole

Chemical Properties

Melting point 180-182 °C (lit.)
Boiling point 290.19°C (rough estimate)
Density  1.4141 (rough estimate)
refractive index  1.5500 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  very faint turbidity in hot Methanol
form  Powder
pka 11.08±0.40(Predicted)
color  Light Yellow
BRN  7812
InChI InChI=1S/C7H5N3O2/c11-10(12)6-2-1-5-4-8-9-7(5)3-6/h1-4H,(H,8,9)
InChIKey ORZRMRUXSPNQQL-UHFFFAOYSA-N
SMILES N1C2=C(C=CC([N+]([O-])=O)=C2)C=N1
CAS DataBase Reference 7597-18-4(CAS DataBase Reference)
NIST Chemistry Reference 6-Nitroindazole(7597-18-4)
EPA Substance Registry System 1H-Indazole, 6-nitro- (7597-18-4)

Safety Information

Hazard Codes  Xn,Xi
Risk Statements  20/21/22-36/37/38-40-68-36
Safety Statements  26-27-36/37/39
WGK Germany  3
RTECS  NK7962100
TSCA  TSCA listed
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

MSDS

Usage And Synthesis

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