956460-96-1

Name 4-Piperidinecarboxylicacid,4-[[(1,1-diMethylethoxy)carbonyl]aMino]-1-(7H-pyrrolo[2,3-d]pyriMidin-4-yl)-
CAS 956460-96-1
Molecular Formula C17H23N5O4
MDL Number MFCD13177874
Molecular Weight 361.4
MOL File 956460-96-1.mol
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Chemical Properties

density  1.37±0.1 g/cm3(Predicted)
storage temp.  Store at 0-8 °C
pka 3.62±0.20(Predicted)
Appearance white solid
InChI InChI=1S/C17H23N5O4/c1-16(2,3)26-15(25)21-17(14(23)24)5-8-22(9-6-17)13-11-4-7-18-12(11)19-10-20-13/h4,7,10H,5-6,8-9H2,1-3H3,(H,21,25)(H,23,24)(H,18,19,20)
InChIKey BXOSYQSFTOLZST-UHFFFAOYSA-N
SMILES N1(C2N=CN=C3NC=CC3=2)CCC(NC(OC(C)(C)C)=O)(C(O)=O)CC1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H317-H319
Precautionary statements  P280-P305+P351+P338
HS Code  2933998090

Spectrum Detail

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