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499-04-7

Name ARECAIDINE BUT-2-YNYL ESTER TOSYLATE
CAS 499-04-7
Molecular Formula C18H23NO5S
MDL Number MFCD00153913
Molecular Weight 365.44
MOL File 499-04-7.mol
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Chemical Properties

Appearance Crystalline Solid
Melting point  232°C (dec.)
Boiling point  104-112℃ (14-16 Torr)
density  1.166±0.06 g/cm3 (20 ºC 760 Torr)
refractive index  1.5026 (estimate)
Fp  115.1±25.9℃
storage temp.  Store at RT
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka pKa 9.07(H2O t=25)(Approximate)
color  Plates from dil alc
InChI InChI=1S/C7H11NO2/c1-8-4-2-3-6(5-8)7(9)10/h3H,2,4-5H2,1H3,(H,9,10)
InChIKey DNJFTXKSFAMXQF-UHFFFAOYSA-N
SMILES C1N(C)CCC=C1C(O)=O
LogP 0.770 (est)
CAS DataBase Reference 499-04-7

Safety Data

Toxicity
sce-mus-ipr 1 g/kg/5D-I CALEDQ 23,189,84

Hazard Information

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