1919837-50-5

Name 3-Azetidineacetonitrile, 1-(ethylsulfonyl)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]-
CAS 1919837-50-5
EINECS(EC#) 213-152-9
Molecular Formula C16H25BN4O4S
MDL Number MFCD30530467
Molecular Weight 380.27
MOL File 1919837-50-5.mol
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Chemical Properties

Boiling point  572.6±60.0 °C(Predicted)
density  1.27±0.1 g/cm3(Predicted)
storage temp.  Storage temp. -20°C
pka 2.63±0.19(Predicted)
Appearance White to off-white Solid
InChI InChI=1S/C16H25BN4O4S/c1-6-26(22,23)20-11-16(12-20,7-8-18)21-10-13(9-19-21)17-24-14(2,3)15(4,5)25-17/h9-10H,6-7,11-12H2,1-5H3
InChIKey LHTUCYOPHHHUEE-UHFFFAOYSA-N
SMILES N1(S(CC)(=O)=O)CC(N2C=C(B3OC(C)(C)C(C)(C)O3)C=N2)(CC#N)C1

Safety Data

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

Spectrum Detail

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