84-31-1

Name QUININONE (50 MG)
CAS 84-31-1
EINECS(EC#) 201-524-4
Molecular Formula C20H22N2O2
Molecular Weight 322.4
MOL File 84-31-1.mol
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Chemical Properties

Melting point  108° (rapid heating)
alpha  D20 +76° (c = 2 in alcohol)
Boiling point  461.02°C (rough estimate)
density  1.1478 (rough estimate)
refractive index  1.5700 (estimate)
solubility  Acetonitrile (Slightly), Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
form  Solid
color  White to Pale Beige
Water Solubility  3mg/L(20 ºC)
Major Application pharmaceutical (small molecule)
InChI 1S/C20H22N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19H,1,7,9-10,12H2,2H3
InChIKey SRFCUPVBYYAMIL-UHFFFAOYSA-N
SMILES N21C(CC(C(C2)C=C)CC1)C(=O)c3c4c(ncc3)ccc(c4)OC

Safety Data

WGK Germany  WGK 3
HS Code  2939200050
Storage Class 11 - Combustible Solids

Hazard Information

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