121695-40-7

Name L-PHENYL-D5-ALANINE-N-T-BOC
CAS 121695-40-7
Molecular Formula C14H14D5NO4
MDL Number MFCD01074193
Molecular Weight 270.34
MOL File 121695-40-7.mol
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Chemical Properties

Appearance Off-White Solid
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)
storage temp.  Refrigerator
solubility  Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
form  Solid
pka 3.881±0.10(predicted)
color  White to Off-White
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
InChIKey ZYJPUMXJBDHSIF-MEKJEUOKSA-N
SMILES [2H]c1c([2H])c([2H])c(C[C@H](NC(=O)OC(C)(C)C)C(O)=O)c([2H])c1[2H]
CAS Number Unlabeled 13734-34-4

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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