2755812-45-2

Name (1R,2S,5S)-3-((S)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
CAS 2755812-45-2
Molecular Formula C16H23F3N2O4
Molecular Weight 364.36
MOL File 2755812-45-2.mol
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Chemical Properties

Boiling point  495.1±45.0 °C(Predicted)
density  1.290±0.06 g/cm3(Predicted)
storage temp.  Store at room temperature
pka 3.26±0.40(Predicted)
Appearance White to off-white Solid
InChI InChI=1S/C16H23F3N2O4/c1-14(2,3)10(20-13(25)16(17,18)19)11(22)21-6-7-8(15(7,4)5)9(21)12(23)24/h7-10H,6H2,1-5H3,(H,20,25)(H,23,24)/t7-,8-,9-,10+/m0/s1
InChIKey JDMCUFJAHAVBLQ-AATLWQCWSA-N
SMILES [C@@]12([H])[C@@]([H])(C1(C)C)CN(C(=O)[C@@H](NC(C(F)(F)F)=O)C(C)(C)C)[C@@H]2C(O)=O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P280-P305+P351+P338
REACH Registrations Active

Spectrum Detail

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