1841460-82-9

Name TH1020
CAS 1841460-82-9
Molecular Formula C23H15N7S2
MDL Number MFCD30480930
Molecular Weight 453.54
MOL File 1841460-82-9.mol
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Chemical Properties

Boiling point  765.8±70.0 °C(Predicted)
density  1.51±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Chloroform: 1 mg/ml
form  powder
pka 1.92±0.10(Predicted)
color  white to beige
InChI InChI=1S/C23H15N7S2/c1-2-5-15(6-3-1)13-30-20(16-8-11-24-12-9-16)28-29-23(30)32-22-19-18(26-14-27-22)17-7-4-10-25-21(17)31-19/h1-12,14H,13H2
InChIKey CBBXTGWSGPEJEE-UHFFFAOYSA-N
SMILES C1=NC(SC2N(CC3=CC=CC=C3)C(C3C=CN=CC=3)=NN=2)=C2SC3=NC=CC=C3C2=N1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

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