diacetin


3-acetoxy-2-hydroxypropyl acetate; diacetin; diacetylglycerol; glycerin diacetate; glycerol diacetate; glyceryl diacetate; glyceryl-1,3-diacetate
Links:📖 PubMed,
📖Houben-Weyl, 2. Band (Diacetin); p. 486, 530,
CAS RN:[25395-31-7]
Formula:C7H12O5; 176.17 g/mol
InChiKey:TWSUHSVPDUPKDH-UHFFFAOYSA-N
SMILES:CC(=O)OCC(O)COC(C)=O.CC(=O)OCC(CO)OC(C)=O
Molecular structure of diacetin
Toxicology (LD50):2 714 mg/Kg (mouse, iv); 10 030 mg/Kg(mouse, or); 2 950 mg/Kg(mouse, sc); 4 720 mg/Kg(rat, sc)
Density:1.184 g/mL
Molar volume:148.8 mL/mol
Refractive index:1.411
Molecular refractive power:36.94 mL/mol
Melting point:40 °C
Boiling point:280 °C

Isomers

diacetin
Molecular structure of diacetin
dimethyl 3-hydroxyglutarate
Molecular structure of dimethyl 3-hydroxyglutarate
methyl 3,6-anhydro-β-D-glucopyranoside
Molecular structure of methyl 3,6-anhydro-b-D-glucopyranoside
methyl 2-[(ethoxycarbonyl)oxy]propanoate
Molecular structure of methyl 2-[(ethoxycarbonyl)oxy]propanoate