107007-95-4

Name Endo-3-amine-9-methyl-9-azabicyclo[3,3,1]nonane
CAS 107007-95-4
Molecular Formula C17 H22 N4 O
MDL Number MFCD00872014
Molecular Weight 298.38
MOL File 107007-95-4.mol
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Chemical Properties

Melting point  217-219℃
Boiling point  558.084±40.00 °C(Press: 760.00 Torr)(predicted)
density  1.267±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly, Heated, Sonicated)
form  neat
pka 11.582±0.10(predicted)
color  Pale Beige to Brown
Major Application pharmaceutical
InChI InChI=1/C17H22N4O/c1-21-12-5-4-6-13(21)10-11(9-12)18-17(22)16-14-7-2-3-8-15(14)19-20-16/h2-3,7-8,11-13H,4-6,9-10H2,1H3,(H,18,22)(H,19,20)/t11-,12+,13-
InChIKey GHVQAOGYNZNTIA-CLLJXQQHNA-N
SMILES C(C1=NNC2=CC=CC=C12)(=O)N[C@@H]1C[C@@H]2CCC[C@@H](N2C)C1 |&1:12,14,18,r|

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P301+P312+P330
WGK Germany  WGK 3
HS Code  2933399090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Spectrum Detail

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