307983-31-9

Name GRA Ex-25
CAS 307983-31-9
Molecular Formula C29H36F3N3O5
MDL Number MFCD11977277
Molecular Weight 563.61
MOL File 307983-31-9.mol
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Chemical Properties

Melting point  152-154 °C
Boiling point  726.3±60.0 °C(Predicted)
density  1.28±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  DMF:25.0(Max Conc. mg/mL);44.36(Max Conc. mM)
DMSO:28.5(Max Conc. mg/mL);50.57(Max Conc. mM)
DMF:PBS (pH 7.2) (1:8):0.1(Max Conc. mg/mL);0.18(Max Conc. mM)
Ethanol:10.0(Max Conc. mg/mL);17.74(Max Conc. mM)
form  A crystalline solid
pka 4.29±0.10(Predicted)
color  White to off-white
InChIKey BZXMLCVDKDXRQY-AFARHQOCNA-N
SMILES C(C)(C)([C@@H]1CC[C@H](CC1)N(CC1=CC=C(C=C1)C(=O)NCCC(=O)O)C(=O)NC1=CC=C(C=C1)OC(F)(F)F)C |&1:3,6,r|

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