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25197-96-0

Name 5-METHOXY-L-TRYPTOPHAN
CAS 25197-96-0
Molecular Formula C12H14N2O3
MDL Number MFCD01074513
Molecular Weight 234.25
MOL File 25197-96-0.mol
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Chemical Properties

Melting point  253-256 °C
Boiling point  478.3±45.0 °C(Predicted)
density  1.347±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
form  solid
pka 2.22±0.10(Predicted)
color  off-white to light yellow
Optical Rotation [α]20/D -30 to -28° in water
InChI 1S/C12H14N2O3/c1-17-8-2-3-11-9(5-8)7(6-14-11)4-10(13)12(15)16/h2-3,5-6,10,14H,4,13H2,1H3,(H,15,16)/t10-/m0/s1
InChIKey KVNPSKDDJARYKK-JTQLQIEISA-N
SMILES [N+H3][C@@H](Cc1c2c([nH]c1)ccc(c2)OC)C(=O)[O-]

Safety Data

Symbol(GHS) 
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P301+P310+P330
WGK Germany  WGK 1
HS Code  2933998090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

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