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N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanine Structure

N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanine

Chemical Properties

Melting point 150-152 °C(lit.)
Boiling point 422.1°C (rough estimate)
alpha  +28° (20℃/D)(c=1, CH3OH)
Density  1.1083 (rough estimate)
vapor pressure  1.95hPa at 25℃
refractive index  29.5 ° (C=1, MeOH)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  6g/l
pka 2.14±0.10(Predicted)
form  Crystalline Powder
color  White
optical activity [α]20/D +28°, c = 1 in methanol
Water Solubility  100mg/L at 25℃
BRN  3619501
Major Application peptide synthesis
InChI 1S/C15H21NO4/c1-3-20-15(19)13(16-11(2)14(17)18)10-9-12-7-5-4-6-8-12/h4-8,11,13,16H,3,9-10H2,1-2H3,(H,17,18)/t11-,13-/m0/s1
InChIKey CEIWXEQZZZHLDM-AAEUAGOBSA-N
SMILES CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(O)=O
LogP 0.12 at 25℃
CAS DataBase Reference 82717-96-2(CAS DataBase Reference)
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Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  37/39-26-36
WGK Germany  3
HS Code  29224999
Storage Class 11 - Combustible Solids

MSDS

Usage And Synthesis

Preparation Products And Raw materials

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