1354707-41-7

Name Mitochonic acid 5
CAS 1354707-41-7
Molecular Formula C18H13F2NO3
MDL Number MFCD31657404
Molecular Weight 329.3
MOL File 1354707-41-7.mol
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Chemical Properties

Boiling point  573.3±50.0 °C(Predicted)
density  1.426±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO:106.66(Max Conc. mg/mL);323.9(Max Conc. mM)
form  A solid
pka 4.52±0.37(Predicted)
color  Light yellow to yellow
InChI 1S/C18H13F2NO3/c19-10-5-6-12(15(20)7-10)17(22)8-13(18(23)24)14-9-21-16-4-2-1-3-11(14)16/h1-7,9,13,21H,8H2,(H,23,24)
InChIKey BOKQALWNGNLTOC-UHFFFAOYSA-N
SMILES OC(C(CC(C1=C(F)C=C(F)C=C1)=O)C2=CNC3=CC=CC=C32)=O

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  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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