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L-allo-Isoleucine Structure

L-allo-Isoleucine

Chemical Properties

Melting point ~285 °C
Boiling point 225.8±23.0 °C(Predicted)
Density  1.2930 (estimate)
refractive index  1.4630 (estimate)
storage temp.  Store at RT.
solubility  Methanol (Slightly, Heated), Water (Slightly, Sonicated)
form  Powder
pka 2.57±0.24(Predicted)
color  White
optical activity +15.925 (H2O)+39.625 (5 mol dm-3 HCl)
Water Solubility  28.18g/L(20 ºC)
BRN  1721791
InChI 1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
InChIKey AGPKZVBTJJNPAG-UHNVWZDZSA-N
SMILES CC[C@@H](C)[C@H](N)C(O)=O
CAS DataBase Reference 1509-34-8(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
RTECS  BA2933000
HS Code  29224985
Storage Class 11 - Combustible Solids
Toxicity rat,LD50,intraperitoneal,6954mg/kg (6954mg/kg),Archives of Biochemistry and Biophysics. Vol. 58, Pg. 253, 1955.

MSDS

Usage And Synthesis

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