9-[(2-Acetoxyethoxy)methyl]-N2-acetylguanine Structure

9-[(2-Acetoxyethoxy)methyl]-N2-acetylguanine

Chemical Properties

Melting point 204°C
Density  1.53
storage temp.  2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 8.77±0.20(Predicted)
color  White to Light Beige
InChI InChI=1S/C12H15N5O5/c1-7(18)14-12-15-10-9(11(20)16-12)13-5-17(10)6-21-3-4-22-8(2)19/h5H,3-4,6H2,1-2H3,(H2,14,15,16,18,20)
InChIKey VBHLKZHSCMQLTI-UHFFFAOYSA-N
SMILES C(NC1NC(=O)C2=C(N=1)N(COCCOC(C)=O)C=N2)(=O)C
LogP -0.85
CAS DataBase Reference 75128-73-3(CAS DataBase Reference)
FDA UNII U32280404H
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P305+P351+P338
Hazard Codes  Xn,Xi
Risk Statements  20/21/22-36/37/38
Safety Statements  26-36-37/39
HS Code  2933599550

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9-[(2-Acetoxyethoxy)methyl]-N2-acetylguanine Chemical Properties,Usage,Production

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