287980-84-1

Name BIRG 616 BS
CAS 287980-84-1
Molecular Formula C12H10N4O
Molecular Weight 226.23
MOL File 287980-84-1.mol
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Chemical Properties

Boiling point  366.4±42.0 °C(Predicted)
density  1.292±0.06 g/cm3(Predicted)
pka 11.45±0.20(Predicted)
Major Application pharmaceutical (small molecule)
InChI 1S/C12H10N4O/c1-7-4-6-14-11-9(7)15-12(17)8-3-2-5-13-10(8)16-11/h2-6H,1H3,(H,15,17)(H,13,14,16)
InChIKey RKCRKBSFEVQVSX-UHFFFAOYSA-N
SMILES [nH]1c2nccc(c2[nH][c](c3c1nccc3)=O)C

Safety Data

WGK Germany  WGK 3
HS Code  2933997500
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Hazard Information

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