1991986-30-1

Name ML364
CAS 1991986-30-1
Molecular Formula C24H18F3N3O3S2
MDL Number MFCD30718174
Molecular Weight 517.54
MOL File 1991986-30-1.mol
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Chemical Properties

density  1.457±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,Store in freezer, under -20°C
solubility  DMF: 30 mg/ml; DMSO: 30 mg/ml; DMSO:PBS (pH 7.2) (1:2): 0.33 mg/ml; Ethanol: 20 mg/ml
form  A crystalline solid
pka 6.51±0.50(Predicted)
color  Light yellow to yellow
InChI InChI=1S/C24H18F3N3O3S2/c1-15-7-10-18(11-8-15)35(32,33)30-20-13-17(24(25,26)27)9-12-19(20)22(31)29-23-28-21(14-34-23)16-5-3-2-4-6-16/h2-14,30H,1H3,(H,28,29,31)
InChIKey QZUGMNXETPARLI-UHFFFAOYSA-N
SMILES FC(F)(F)c1cc(c(cc1)C(=O)Nc3[s]cc(n3)c4ccccc4)N[S](=O)(=O)c2ccc(cc2)C

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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