524-63-0

Name cupreine
CAS 524-63-0
EINECS(EC#) 208-363-9
Molecular Formula C19H22N2O2
MDL Number MFCD09842542
Molecular Weight 310.395
MOL File 524-63-0.mol
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Chemical Properties

Definition One of the cinchona alkaloids.
Melting point  >171°C (dec.)
alpha  D17 -176°
Boiling point  450.55°C (rough estimate)
density  1.1396 (rough estimate)
refractive index  1.5600 (estimate)
storage temp.  -20?C Freezer
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 6.57(at 25℃)
color  Off-White to Pale Yellow
InChI InChI=1/C19H22N2O2/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17/h2-5,7,10,12-13,18-19,22-23H,1,6,8-9,11H2/t12-,13+,18+,19-/s3
InChIKey VJFMSYZSFUWQPZ-HQKGGXQFNA-N
SMILES N12CC[C@@]([C@H](C=C)C1)([H])C[C@@]2([H])[C@H](O)C1=CC=NC2C=CC(O)=CC1=2 |&1:3,4,10,12,r|

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