76536-66-8

Name 9,10-dimethoxy-2-(2,4,6-trimethylanilino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CAS 76536-66-8
Molecular Formula C23H25N3O3
Molecular Weight 391.46
MOL File 76536-66-8.mol
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Chemical Properties

Melting point  287-288 °C
Boiling point  559.2±60.0 °C(Predicted)
density  1.24±0.1 g/cm3(Predicted)
pka 3.52±0.20(Predicted)
InChI InChI=1S/C23H25N3O3/c1-13-8-14(2)22(15(3)9-13)24-21-12-18-17-11-20(29-5)19(28-4)10-16(17)6-7-26(18)23(27)25-21/h8-12H,6-7H2,1-5H3,(H,24,25,27)
InChIKey FJVQNSDTSROABN-UHFFFAOYSA-N
SMILES C12=CC(NC3=C(C)C=C(C)C=C3C)=NC(=O)N1CCC1=C2C=C(OC)C(OC)=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P280-P305+P351+P338

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