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  • Triethyl O-Acetylcitrate

    Catalog Number
    ACM77894-1
    CAS Number
    77-89-4
    Product Name
    Triethyl O-Acetylcitrate
    Structure
    Category
    Plastic Additives; Plasticizers
    Synonyms
    triethyl 2-acetyloxypropane-1,2,3-tricarboxylate;1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, triethyl ester;
    Description
    Triethyl O-Acetylcitrate is used in the preparation of poly(lactic) acid biodegradable and flexible films, acting as a plasticizer. Also used in the synthesis of control-release capsules containing polymeric coatings.
    IUPAC Name
    triethyl 2-acetyloxypropane-1,2,3-tricarboxylate
    Molecular Weight
    318.32g/mol
    Molecular Formula
    C14H22O8
    Canonical SMILES
    CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C
    InChI
    InChI=1S/C14H22O8/c1-5-19-11(16)8-14(22-10(4)15,13(18)21-7-3)9-12(17)20-6-2/h5-9H2,1-4H3
    InChI Key
    WEAPVABOECTMGR-UHFFFAOYSA-N
    Melting Point
    -42ºC
    Flash Point
    >110ºC
    Density
    1.137
    Appearance
    Colorless or light yellow liquid
    Complexity
    395
    Covalently-Bonded Unit Count
    1
    EC Number
    201-066-5
    Exact Mass
    318.131468g/mol
    Formal Charge
    0
    Heavy Atom Count
    22
    Log P
    0.75780
    MeSH Entry Terms
    acetyl triethyl citrate
    Monoisotopic Mass
    318.131468g/mol
    NSC Number
    3887
    Refractive Index
    1.439
    Rotatable Bond Count
    13
    UNII
    5WBR36T90E
    WGK Germany
    1
    XLogP3
    0.6
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