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Boc-D-3-benzothienylalanine Structure

Boc-D-3-benzothienylalanine

Chemical Properties

Melting point 63-67 °C(Solv: ethanol (64-17-5))
Boiling point 514.1±45.0 °C(Predicted)
Density  1.274±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,2-8°C
pka 3.85±0.10(Predicted)
Appearance Off-white to light brown Solid
BRN  8995535
InChI InChI=1/C16H19NO4S/c1-16(2,3)21-15(20)17-12(14(18)19)8-10-9-22-13-7-5-4-6-11(10)13/h4-7,9,12H,8H2,1-3H3,(H,17,20)(H,18,19)/t12-/s3
InChIKey MURVSBJYXHTRJQ-PLAQIDKDNA-N
SMILES C12C=CC=CC=1SC=C2C[C@H](C(=O)O)NC(=O)OC(C)(C)C |&1:10,r|
CAS DataBase Reference 111082-76-9(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
WGK Germany  3
F  10-23
HazardClass  IRRITANT
HS Code  2934999090

MSDS

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