72795-19-8

Name ICI-118,551
CAS 72795-19-8
Molecular Formula C17H27NO2
MDL Number MFCD01074480
Molecular Weight 277.4
MOL File 72795-19-8.mol
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Chemical Properties

Melting point  217-219°C
Boiling point  439.3±45.0 °C(Predicted)
density  1.045±0.06 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  ethanol: 7.3 mg/mL
form  powder
pka 13.87±0.20(Predicted)
color  white
InChI 1S/C17H27NO2/c1-11(2)18-13(4)16(19)10-20-17-9-8-12(3)14-6-5-7-15(14)17/h8-9,11,13,16,18-19H,5-7,10H2,1-4H3/t13-,16-/m0/s1
InChIKey VFIDUCMKNJIJTO-BBRMVZONSA-N
SMILES N([C@H]([C@@H](O)COc1c2c(c(cc1)C)CCC2)C)C(C)C

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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