1224925-76-1

Name GRANISETRON-D3
CAS 1224925-76-1
Molecular Formula C18H21D3N4O
MDL Number MFCD08063449
Molecular Weight 315.43
MOL File 1224925-76-1.mol
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Chemical Properties

Appearance White to Off-White Crystalline Sold
Melting point  290-292°C
Boiling point  532.016±40.00 °C(Press: 760.00 Torr)(predicted)
density  1.330±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.  -20°C Freezer
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 12.341±0.20(predicted)
color  White to Off-White
InChI InChI=1/C18H24N4O/c1-21-13-6-5-7-14(21)11-12(10-13)19-18(23)17-15-8-3-4-9-16(15)22(2)20-17/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,19,23)/t12-,13+,14-/i2D3
InChIKey MFWNKCLOYSRHCJ-JQHPXDLNNA-N
SMILES C1(C(=O)N[C@H]2C[C@@]3([H])CCC[C@@](N3C)([H])C2)C2C=CC=CC=2N(C([2H])([2H])[2H])N=1 |&1:4,6,11,r|
CAS DataBase Reference 1224925-76-1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning

Hazard Information

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