106881-07-6

Name L-PHENYL-D5-ALANINE-2,3,3-D3-N-T-BOC
CAS 106881-07-6
Molecular Formula C14H11D8NO4
MDL Number MFCD01075441
Molecular Weight 273.35
MOL File 106881-07-6.mol
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Chemical Properties

Melting point  85-87 °C(lit.)
Boiling point  426.619±38.00 °C(Press: 760.00 Torr)(predicted)
density  1.160±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
form  solid
pka 3.881±0.10(predicted)
Optical Rotation [α]20/D +25°, c =1 in ethanol
Major Application peptide synthesis
InChI 1S/C14H19NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1/i4D,5D,6D,7D,8D,9D2,11D
InChIKey ZYJPUMXJBDHSIF-ZAYSQZROSA-N
SMILES [2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])[C@]([2H])(NC(=O)OC(C)(C)C)C(O)=O

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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