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Ibrutinib CAS 936563-96-1

AccordingtoLuimatinib;PCI-32765;1-[(3R)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-propen-1-one;2-Propen-1-one,1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazChemicalbookolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-;IBRUTINIB(PCI-32765);PCI32765;(R)-1-(3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo-[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-;PCI-32765(Ibrutinib);IBRUTINIB
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  • 936563-96-1

  • bosschem

  • 936563-96-1

Ibrutinib Basic information
Product Name: Ibrutinib
CAS: 936563-96-1
MF: C25H24N6O2
MW: 440.5
EINECS: 805-642-2
Mol File: 936563-96-1.mol
Ibrutinib Chemical Properties
Melting point 153-158°C
Boiling point 715.0±60.0 °C(Predicted)
density 1.34
storage temp. -20°C
solubility Soluble in DMSO ( up to at least 25 mg/ml)
form solid
pka 4.09±0.30(Predicted)
color White or off-white
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months.
InChIKey XYFPWWZEPKGCCK-GOSISDBHSA-N
SMILES C(N1CCC[C@@H](N2C3C(C(C4=CC=C(OC5=CC=CC=C5)C=C4)=N2)=C(N)N=CN=3)C1)(=O)C=C
CAS DataBase Reference 936563-96-1

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