75128-73-3

Name 9-[(2-Acetoxyethoxy)methyl]-N2-acetylguanine
CAS 75128-73-3
EINECS(EC#) 278-077-7
Molecular Formula C12H15N5O5
MDL Number MFCD00267706
Molecular Weight 309.28
MOL File 75128-73-3.mol
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Chemical Properties

Appearance white to light yellow crystal powder
Melting point  204°C
density  1.53
storage temp.  Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 8.77±0.20(Predicted)
color  White to Light Beige
Usage An impurity of Acyclovir
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)

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 .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
REACH Registrations Active
HS Code  2933599550

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Hazard Information

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