(S)-N-Boc-3-Amino-3-phenylpropanoic acid Structure

(S)-N-Boc-3-Amino-3-phenylpropanoic acid

Chemical Properties

Melting point 122.9 °C
Boiling point 408.52°C (rough estimate)
Density  1.1356 (rough estimate)
refractive index  1.5110 (estimate)
storage temp.  2-8°C
pka 4.32±0.10(Predicted)
Appearance White to off-white Solid
Major Application peptide synthesis
InChI 1S/C14H19NO4/c1-14(2,3)19-13(18)15-11(9-12(16)17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1
InChIKey JTNQFJPZRTURSI-NSHDSACASA-N
SMILES CC(C)(C)OC(=O)N[C@@H](CC(O)=O)c1ccccc1
CAS DataBase Reference 103365-47-5(CAS DataBase Reference)
UNSPSC Code 12352200
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P305+P351+P338
Safety Statements  24/25
WGK Germany  WGK 3
HazardClass  IRRITANT
HS Code  29242990
Storage Class 13 - Non Combustible Solids
NFPA 704:
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(S)-N-Boc-3-Amino-3-phenylpropanoic acid Spectrum