1357349-91-7

Name 1-(1-Methylethyl)-3-(2-phenylethynyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CAS 1357349-91-7
Molecular Formula C16H15N5
Molecular Weight 277.32
MOL File 1357349-91-7.mol
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Chemical Properties

Boiling point  495.3±40.0 °C(Predicted)
density  1.23±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  Soluble in DMSO
form  Solid
pka 3.95±0.30(Predicted)
color  Off-white to light yellow
InChI 1S/C16H15N5/c1-11(2)21-16-14(15(17)18-10-19-16)13(20-21)9-8-12-6-4-3-5-7-12/h3-7,10-11H,1-2H3,(H2,17,18,19)
InChIKey JQOIRTDBHMDWMT-UHFFFAOYSA-N
SMILES NC1=NC=NC2=C1C(C#CC3=CC=CC=C3)=NN2C(C)C

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Spectrum Detail

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