112889-02-8

Name Diethyl N-[5-methylamino-2-thenoyl]-L-glutamate
CAS 112889-02-8
Molecular Formula C15H22N2O5S
MDL Number MFCD09750956
Molecular Weight 342.41
MOL File 112889-02-8.mol
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Chemical Properties

Boiling point  519.6±50.0 °C(Predicted)
density  1.231
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
pka 12.89±0.46(Predicted)
InChI InChI=1S/C15H22N2O5S/c1-4-21-13(18)9-6-10(15(20)22-5-2)17-14(19)11-7-8-12(16-3)23-11/h7-8,10,16H,4-6,9H2,1-3H3,(H,17,19)/t10-/m0/s1
InChIKey OIUDYHGOODXYDK-JTQLQIEISA-N
SMILES C(OCC)(=O)[C@H](CCC(OCC)=O)NC(C1SC(NC)=CC=1)=O

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