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166247-63-8

Name 7-DEAZA-7-IODO-2'-DEOXYADENOSINE
CAS 166247-63-8
EINECS(EC#) 2017-001-1
Molecular Formula C11H13IN4O3
MDL Number MFCD07778650
Molecular Weight 376.15
MOL File 166247-63-8.mol

Chemical Properties

Melting point  >206°C (dec.)
Boiling point  657.4±55.0 °C(Predicted)
density  2.35±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly, Heated)
form  Solid
pka 13.27±0.60(Predicted)
color  White to Off-White
Stability: Light Sensitive
InChI InChI=1/C11H13IN4O3/c12-5-2-16(8-1-6(18)7(3-17)19-8)11-9(5)10(13)14-4-15-11/h2,4,6-8,17-18H,1,3H2,(H2,13,14,15)/t6-,7+,8-/s3
InChIKey LIIIRHQRQZIIRT-CENUSHNHNA-N
SMILES C1N=C(N)C2C(I)=CN([C@H]3O[C@H](CO)[C@H](C3)O)C=2N=1 |&1:9,11,14,r|

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

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