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1-MethylInosine Structure

1-MethylInosine

Chemical Properties

Melting point: 211-212 °C
Boiling point: 695.3±65.0 °C(Predicted)
Density  1.88±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : 20.83 mg/mL (73.80 mM; Need ultrasonic)
form  A solid
pka 13.22±0.70(Predicted)
color  White to off-white
λmax 249 (pH 6)
InChI InChI=1/C11H16N4O5/c1-14-3-13-9-6(10(14)19)12-4-15(9)11-8(18)7(17)5(2-16)20-11/h4-5,7-8,11,16-19H,2-3H2,1H3/t5-,7-,8-,11-/s3
InChIKey QCTGLUIBIHRABQ-ABFAXUGDNA-N
SMILES OC[C@H]1O[C@@H](N2C3C(=C(N(C)CN=3)O)N=C2)[C@H](O)[C@@H]1O |&1:2,4,16,18,r|

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P321-P362+P364-P332+P313-P337+P313-P403+P233-P405-P501
HS Code  2938909090
NFPA 704:
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