9-(2'-ACETOXYETHOXYMETHYL)-GUANINE Structure

9-(2'-ACETOXYETHOXYMETHYL)-GUANINE

Chemical Properties

Melting point 242-244°C (dec.)
Density  1.61±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly, Heated)
pka 9.34±0.20(Predicted)
Appearance White to off-white Solid
Major Application pharmaceutical small molecule
InChI InChI=1S/C10H13N5O4/c1-6(16)19-3-2-18-5-15-4-12-7-8(15)13-10(11)14-9(7)17/h4H,2-3,5H2,1H3,(H3,11,13,14,17)
InChIKey DMHAXLGAKQREIL-UHFFFAOYSA-N
SMILES N1C2=C(N=C(N)NC2=O)N(COCCOC(C)=O)C=1
CAS DataBase Reference 102728-64-3
FDA UNII Y16CE349S3
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Health Hazard (GHS08)
Signal wordWarning
Hazard statements H341
Precautionary statements P201-P202-P280-P308+P313-P405-P501
Hazard Codes  Xn
Risk Statements  68
Safety Statements  36/37
WGK Germany  WGK 3
HS Code  2933599550
Storage Class 13 - Non Combustible Solids
Hazard Classifications Muta. 2

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9-(2'-ACETOXYETHOXYMETHYL)-GUANINE Spectrum