444722-95-6

Name NU6102
CAS 444722-95-6
Molecular Formula C18H22N6O3S
MDL Number MFCD08702693
Molecular Weight 402.47
MOL File 444722-95-6.mol

Chemical Properties

Melting point  152-154℃ (water )
storage temp.  Store at -20°C
solubility  DMSO:1.0(Max Conc. mg/mL);2.5(Max Conc. mM)
form  White to off-white solid.
color  White to off-white
InChI 1S/C18H22N6O3S/c19-28(25,26)14-8-6-13(7-9-14)22-18-23-16-15(20-11-21-16)17(24-18)27-10-12-4-2-1-3-5-12/h6-9,11-12H,1-5,10H2,(H2,19,25,26)(H2,20,21,22,23,24)
InChIKey OWXORKPNCHJYOF-UHFFFAOYSA-N
SMILES [S](=O)(=O)(N)c1ccc(cc1)Nc2nc3[nH]cnc3c(n2)OCC4CCCCC4

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Warning
Hazard statements  H341
Precautionary statements  P201-P202-P280-P308+P313-P405-P501
WGK Germany  WGK 1
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

Supplier