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trans-racemic-1-Benzyl-4-tert-butoxycarbonylamino-pyrrolidine-3-carboxylic acid Structure

trans-racemic-1-Benzyl-4-tert-butoxycarbonylamino-pyrrolidine-3-carboxylic acid

Chemical Properties

Melting point 198.1-198.6°C
Boiling point 478.905±45.00 °C(Press: 760.00 Torr)(predicted)
Density  1.210±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka 3.571±0.40(predicted)
form  solid
InChI 1S/C17H24N2O4/c1-17(2,3)23-16(22)18-14-11-19(10-13(14)15(20)21)9-12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3,(H,18,22)(H,20,21)/t13-,14-/m1/s1
InChIKey XQJFVIAIJBWDBL-ZIAGYGMSSA-N
SMILES CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H]1C(O)=O)Cc2ccccc2

Safety Information

Hazard Codes  Xi
WGK Germany  3
HazardClass  IRRITANT
Storage Class 11 - Combustible Solids

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