956590-23-1

Name UNBS-5162
CAS 956590-23-1
Molecular Formula C17H18N4O3
MDL Number MFCD22380608
Molecular Weight 326.35
MOL File 956590-23-1.mol
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Chemical Properties

Boiling point  526.4±35.0 °C(Predicted)
density  1.389±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,2-8°C
solubility  Soluble in DMSO
form  crystalline solid
pka 13.50±0.20(Predicted)
color  Light yellow to yellow
InChI 1S/C17H18N4O3/c1-20(2)6-7-21-15(22)12-5-3-4-10-8-11(19-17(18)24)9-13(14(10)12)16(21)23/h3-5,8-9H,6-7H2,1-2H3,(H3,18,19,24)
InChIKey WCKZRLOUKYFJDY-UHFFFAOYSA-N
SMILES [n]1([c](c2c3c([c]1=O)cccc3cc(c2)NC(=O)N)=O)CCN(C)C

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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