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846557-71-9

Name ML385
CAS 846557-71-9
Molecular Formula C29H25N3O4S
MDL Number MFCD06616124
Molecular Weight 511.59
MOL File 846557-71-9.mol
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Chemical Properties

density  1.374±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO:31.4(Max Conc. mg/mL);61.38(Max Conc. mM)
DMF:30.0(Max Conc. mg/mL);58.64(Max Conc. mM)
DMF:PBS (pH 7.2) (1:3):0.25(Max Conc. mg/mL);0.49(Max Conc. mM)
form  powder
pka 8.92±0.50(Predicted)
color  white to beige
InChIKey LINHYWKZVCNAMQ-UHFFFAOYSA-N
SMILES O1C2=CC=C(CC(NC3=NC(C4C=CC5=C(C=4)CCN5C(=O)C4=CC=CC=C4C)=C(C)S3)=O)C=C2OC1

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

Hazard Information

Spectrum Detail

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