940284-98-0

Name 2-(4-BOC-PIPERAZIN-1-YL)PYRIMIDINE-5-BORONIC ACID PINACOL ESTER
CAS 940284-98-0
Molecular Formula C19H31BN4O4
MDL Number MFCD07781250
Molecular Weight 390.28
MOL File 940284-98-0.mol

Chemical Properties

Melting point  >211°C (dec.)
Boiling point  525.2±60.0 °C(Predicted)
density  1.16±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 4.62±0.42(Predicted)
color  Off-White to Pale Orange
InChI InChI=1S/C19H31BN4O4/c1-17(2,3)26-16(25)24-10-8-23(9-11-24)15-21-12-14(13-22-15)20-27-18(4,5)19(6,7)28-20/h12-13H,8-11H2,1-7H3
InChIKey YODSUBUWTUTLAZ-UHFFFAOYSA-N
SMILES N1(C(OC(C)(C)C)=O)CCN(C2=NC=C(B3OC(C)(C)C(C)(C)O3)C=N2)CC1

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P301+P310
Hazard Codes  T
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGIII
HS Code  2933998090

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