959581-98-7

Name (2S,4R)-1-(tert-butoxycarbonyl)-4-(prop-2-ynyl)pyrrolidine-2-carboxylic acid
CAS 959581-98-7
Molecular Formula C13H19NO4
MDL Number MFCD06659253
Molecular Weight 253.294
MOL File 959581-98-7.mol
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Chemical Properties

Melting point  95-97℃
Boiling point  377.027±27.00 °C(Press: 760.00 Torr)(predicted)
density  1.167±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.  2-8°C
form  lumps
pka 3.887±0.40(predicted)
Optical Rotation [α]/D -34.0±2°, c = 1% in ethanol
Major Application peptide synthesis
InChI 1S/C13H19NO4/c1-5-6-9-7-10(11(15)16)14(8-9)12(17)18-13(2,3)4/h1,9-10H,6-8H2,2-4H3,(H,15,16)/t9-,10+/m1/s1
InChIKey DMBBSZBBZZUEMF-ZJUUUORDSA-N
SMILES CC(C)(C)OC(=O)N1C[C@H](CC#C)C[C@H]1C(O)=O

Safety Data

WGK Germany  3
Storage Class 13 - Non Combustible Solids

Hazard Information

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