2,6-Diamino-4-chloropyrimidine 1-oxide Structure

2,6-Diamino-4-chloropyrimidine 1-oxide

Chemical Properties

Melting point 185 °C (dec.) (lit.)
Boiling point 506.5±53.0 °C(Predicted)
Density  1.91±0.1 g/cm3(Predicted)
vapor pressure  0.001Pa at 25℃
storage temp.  2-8°C, protect from light, stored under nitrogen
solubility  DMSO (Slightly), Dichloromethane (Slightly), Methanol (Slightly)
form  Solid:particulate/powder
pka 1.67±0.10(Predicted)
Appearance White to off-white Solid
Stability Light Sensitive
InChI InChI=1S/C4H5ClN4O/c5-2-1-3(6)9(10)4(7)8-2/h1H,6H2,(H2,7,8)
InChIKey CFHPTZFRFWGDPD-UHFFFAOYSA-N
SMILES C1(N)=NC(Cl)=CC(N)=[N+]1[O-]
LogP 0.18-0.46
CAS DataBase Reference 35139-67-4(CAS DataBase Reference)
FDA UNII BY7Z5QM433
UNSPSC Code 12162002

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-37/39
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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