20880-92-6

Name Diacetonefructose
CAS 20880-92-6
EINECS(EC#) 606-663-8
Molecular Formula C12H20O6
MDL Number MFCD00067639
Molecular Weight 260.28
MOL File 20880-92-6.mol
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Chemical Properties

Appearance White Solid
Melting point  94-95°C
Boiling point  332.6±37.0 °C(Predicted)
density  1.181±0.06 g/cm3(Predicted)
storage temp.  −20°C
solubility  Soluble in chloroform, ethyl acetate, methanol.
form  Powder
pka 14.63±0.10(Predicted)
color  White
Major Application pharmaceutical (small molecule)
InChI InChI=1/C12H20O6/c1-10(2)15-7-5-14-12(6-13)9(8(7)16-10)17-11(3,4)18-12/h7-9,13H,5-6H2,1-4H3/t7-,8-,9+,12+/s3
InChIKey PSSHGMIAIUYOJF-APOZVJGGSA-N
SMILES [C@]12(CO)OC(C)(C)O[C@H]1[C@@H]1OC(C)(C)O[C@@H]1CO2 |&1:0,8,9,15,r|
CAS DataBase Reference 20880-92-6(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P305+P351+P338
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
WGK Germany  3
REACH Registrations Active
HS Code  29400090
Storage Class 11 - Combustible Solids

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