160098-96-4

Name SCH 58261
CAS 160098-96-4
Molecular Formula C18H15N7O
MDL Number MFCD00933778
Molecular Weight 345.365
MOL File 160098-96-4.mol

Chemical Properties

Melting point  223 °C
density  1.54±0.1 g/cm3(Predicted)
storage temp.  Store at RT
solubility  DMSO: >10 mg/mL, soluble
form  solid
pka 2.78±0.30(Predicted)
color  off-white
InChI 1S/C18H15N7O/c19-18-22-16-13(11-20-24(16)9-8-12-5-2-1-3-6-12)17-21-15(23-25(17)18)14-7-4-10-26-14/h1-7,10-11H,8-9H2,(H2,19,22)
InChIKey UTLPKQYUXOEJIL-UHFFFAOYSA-N
SMILES Nc1nc2n(CCc3ccccc3)ncc2c4nc(nn14)-c5ccco5

Safety Data

WGK Germany  3
HS Code  2934.99.3000
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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