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Meta-Topolin Structure

Meta-Topolin

Chemical Properties

Melting point 284-286℃
Boiling point 458.1±55.0 °C(Predicted)
Density  1.49
storage temp.  Store at -20°C
solubility  DMF: 10 mg/ml; DMSO: 30 mg/ml; DMSO:PBS (pH 7.2) (1:5): 0.16 mg/ml
form  A solid
pka 9.89±0.10(Predicted)
color  White to off-white
InChI InChI=1S/C12H11N5O/c18-9-3-1-2-8(4-9)5-13-11-10-12(15-6-14-10)17-7-16-11/h1-4,6-7,18H,5H2,(H2,13,14,15,16,17)
InChIKey BUDWTFCZGZYQHZ-UHFFFAOYSA-N
SMILES C1(O)=CC=CC(CNC2=C3C(=NC=N2)NC=N3)=C1

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H302+H312+H332
Precautionary statements P260-P271
HS Code  2933599590
NFPA 704:
0
3 0

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