40522-46-1

Name 2-Heptylquinoline-4(1H)-one
CAS 40522-46-1
Molecular Formula C16H21NO
MDL Number MFCD16619170
Molecular Weight 243.34
MOL File 40522-46-1.mol

Chemical Properties

Melting point  122-126 °C
Boiling point  361.5±42.0 °C(Predicted)
density  1.013
storage temp.  2-8°C
solubility  DMSO: soluble5mg/mL, clear
form  powder
pka 2.34±0.70(Predicted)
color  white to beige
InChI 1S/C16H21NO/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17-13/h7-8,10-12H,2-6,9H2,1H3,(H,17,18)
InChIKey UYRHHBXYXSYGHA-UHFFFAOYSA-N
SMILES [nH]1c2c([c](cc1CCCCCCC)=O)cccc2

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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