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5470-66-6

Name 4-Nitro-2-picoline N-oxide
CAS 5470-66-6
EINECS(EC#) 628-037-3
Molecular Formula C6H6N2O3
MDL Number MFCD00014625
Molecular Weight 154.12
MOL File 5470-66-6.mol

Chemical Properties

Appearance Yellow Solid
Melting point  155-159 °C(lit.)
Boiling point  277.46°C (rough estimate)
density  1.4564 (rough estimate)
refractive index  1.5100 (estimate)
storage temp.  2-8°C
solubility  DMSO, Methanol
form  powder
pka -1.18±0.10(Predicted)
color  yellow to light orange
λmax 333nm(EtOH)(lit.)
Detection Methods HPLC,NMR
BRN  135501
InChI InChI=1S/C6H6N2O3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3
InChIKey FTTIAVRPJGCXAC-UHFFFAOYSA-N
SMILES C1(C)[N+]([O-])=CC=C([N+]([O-])=O)C=1
CAS DataBase Reference 5470-66-6(CAS DataBase Reference)
NIST Chemistry Reference 4-Nitro-2-picoline-n-oxide(5470-66-6)

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.
Safety Statements 
S22:Do not breathe dust .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
RIDADR  2811
WGK Germany  3
RTECS  UT5710000
HazardClass  6.1
PackingGroup  III
HS Code  29333990

Hazard Information

Material Safety Data Sheet(MSDS)

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