Basic information Safety Related Supplier
5-Isopropyl-1,3-cyclohexanedione Structure

5-Isopropyl-1,3-cyclohexanedione

Chemical Properties

Melting point 63-65 °C (lit.)
Boiling point 259.1±23.0 °C(Predicted)
Density  1.017±0.06 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
form  solid
pka 5.23±0.20(Predicted)
Appearance White to light yellow Solid
InChI 1S/C9H14O2.H2O/c1-6(2)7-3-8(10)5-9(11)4-7;/h6-7H,3-5H2,1-2H3;1H2
InChIKey JYJVWRORYGGPHA-UHFFFAOYSA-N
SMILES [H]O[H].CC(C)C1CC(=O)CC(=O)C1
CAS DataBase Reference 18456-87-6

Safety Information

Hazard Codes  Xi
Risk Statements  43
Safety Statements  36/37
WGK Germany  3
HS Code  2914290090
Storage Class 11 - Combustible Solids

Usage And Synthesis

5-Isopropyl-1,3-cyclohexanedione Supplier