99740-00-8

Name 3-(N-Tosyl-L-alaninyloxy)-5-phenylpyrrole
CAS 99740-00-8
Molecular Formula C20H20N2O4S
MDL Number MFCD23135567
Molecular Weight 384.45
MOL File 99740-00-8.mol

Chemical Properties

Melting point  153-155 °C
Boiling point  613.3±65.0 °C(Predicted)
density  1.286±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
form  Solid
pka 9.05±0.50(Predicted)
color  White to off-white
InChI InChI=1S/C20H20N2O4S/c1-14-8-10-18(11-9-14)27(24,25)22-15(2)20(23)26-17-12-19(21-13-17)16-6-4-3-5-7-16/h3-13,15,21-22H,1-2H3/t15-/m0/s1
InChIKey VZALJYJCTCKOHO-HNNXBMFYSA-N
SMILES C(OC1C=C(C2=CC=CC=C2)NC=1)(=O)[C@H](C)NS(C1=CC=C(C)C=C1)(=O)=O

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

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