5098-11-3

Name 5-Amino-1H-imidazol-4-carbonitrile
CAS 5098-11-3
EINECS(EC#) 225-816-6
Molecular Formula C4H4N4
MDL Number MFCD00129663
Molecular Weight 108.1
MOL File 5098-11-3.mol
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Chemical Properties

Appearance Off-White to Pale Yellow Solid
Melting point  131°C
Boiling point  557.7±35.0 °C(Predicted)
density  1.42±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,2-8°C
solubility  DMSO, Methanol
form  Solid
pka 9.79±0.10(Predicted)
color  Off-White to Pale Yellow
InChI InChI=1S/C4H4N4/c5-1-3-4(6)8-2-7-3/h2H,6H2,(H,7,8)
InChIKey XEPBRDBFOSKYCF-UHFFFAOYSA-N
SMILES C1NC(N)=C(C#N)N=1
CAS DataBase Reference 5098-11-3(CAS DataBase Reference)

Safety Data

Hazard Codes  Xn
Risk Statements 
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
Safety Statements 
S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
RIDADR  3439
WGK Germany  3
HS Code  2933.29.9000
HazardClass  6.1
PackingGroup  III
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1

Hazard Information

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