104104-50-9

Name SR-95531
CAS 104104-50-9
Molecular Formula C15H18BrN3O3
MDL Number MFCD00055135
Molecular Weight 368.23
MOL File 104104-50-9.mol

Chemical Properties

Melting point  200 °C(Solv: ethanol (64-17-5))
storage temp.  Store at RT
solubility  DMSO: 30 mg/mL
form  solid
color  white
Water Solubility  water: 25mM
InChI 1S/C15H17N3O3.BrH/c1-21-12-6-4-11(5-7-12)13-8-9-14(16)18(17-13)10-2-3-15(19)20;/h4-9,16H,2-3,10H2,1H3,(H,19,20);1H
InChIKey GFZHNFOGCMEYTA-UHFFFAOYSA-N
SMILES [Br-].COc1ccc(cc1)-c2ccc(N)[n+](CCCC(O)=O)n2

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P305+P351+P338
WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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