2-ACETYLDIMEDONE Structure

2-ACETYLDIMEDONE

Chemical Properties

Melting point 36-40 °C
Boiling point 132-133 °C
Density  1.077±0.06 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
solubility  soluble in Methanol
form  powder to lump to clear liquid
pka 3.56±0.42(Predicted)
color  White or Colorless to Yellow
BRN  2089698
Major Application peptide synthesis
InChI InChI=1S/C10H14O3/c1-6(11)9-7(12)4-10(2,3)5-8(9)13/h9H,4-5H2,1-3H3
InChIKey ITSKWKZDPHAQNK-UHFFFAOYSA-N
SMILES C1(=O)CC(C)(C)CC(=O)C1C(C)=O
CAS DataBase Reference 1755-15-3
FDA UNII 4M7FS82U08
Proposition 65 List DDE (Dichlorodiphenyldichloroethylene)
UNSPSC Code 12352115
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HS Code  2914290090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Toxicity Principal metabolite of DDT in humans and other animals. Principal long-term storage form derived from DDT in humans and other animals. Biological half-life of several years. DDE is probably related to the chronic toxic effects of DDT such as eggshell thinning. It has been suggested recently that DDT, its metabolites, and other persistent organochlorines are possibly involved in cancer causation, particularly human breast cancer.
NFPA 704:
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