7597-18-4

Name 6-Nitroindazole
CAS 7597-18-4
EINECS(EC#) 231-500-9
Molecular Formula C7H5N3O2
MDL Number MFCD00005695
Molecular Weight 163.13
MOL File 7597-18-4.mol
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Chemical Properties

Appearance yellow powder
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
Usage Anticonvulsant
Detection Methods HPLC
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 7597-18-4(EPA Substance)
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Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R40:Limited evidence of a carcinogenic effect.
R68:Possible risk of irreversible effects.
R36:Irritating to the eyes.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
WGK Germany  3
RTECS  NK7962100
TSCA  Yes
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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