265646-85-3

Name Endovion
CAS 265646-85-3
Molecular Formula C16H9BrF6N6O
MDL Number MFCD28147607
Molecular Weight 495.18
MOL File 265646-85-3.mol
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Chemical Properties

density  1.791±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  Soluble to 100 mM in DMSO and to 50 mM in ethanol
form  Solid
pka 3.95±0.10(Predicted)
color  White to off-white
Water Solubility  Water : < 0.1 mg/mL (insoluble)
InChI 1S/C16H9BrF6N6O/c17-9-1-2-11(13-26-28-29-27-13)12(6-9)25-14(30)24-10-4-7(15(18,19)20)3-8(5-10)16(21,22)23/h1-6H,(H2,24,25,30)(H,26,27,28,29)
InChIKey OQRAKHDEGGGWQO-UHFFFAOYSA-N
SMILES FC(F)(F)c1cc(cc(c1)C(F)(F)F)NC(=O)Nc2c(ccc(c2)Br)c3n[nH]nn3

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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