6154-45-6

Name BZ-TYR-PNA
CAS 6154-45-6
Molecular Formula C22H19N3O5
MDL Number MFCD00038109
Molecular Weight 405.4
MOL File 6154-45-6.mol
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Chemical Properties

Melting point  235-237 °C
Boiling point  776.8±60.0 °C(Predicted)
density  1.373±0.06 g/cm3(Predicted)
storage temp.  −20°C
form  powder
pka 9.87±0.15(Predicted)
color  white
InChI 1S/C22H19N3O5/c26-19-12-6-15(7-13-19)14-20(24-21(27)16-4-2-1-3-5-16)22(28)23-17-8-10-18(11-9-17)25(29)30/h1-13,20,26H,14H2,(H,23,28)(H,24,27)
InChIKey CJERUMAUMMIPRF-UHFFFAOYSA-N
SMILES Oc1ccc(CC(NC(=O)c2ccccc2)C(=O)Nc3ccc(cc3)[N+]([O-])=O)cc1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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