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Diss Factsheets

Identification

Display Name:
Fatty acids, coco, diesters and triesters with trimethylolpropane
EC Number:
812-688-7
CAS Number:
85566-29-6
Molecular formula:
Not applicable, substance is a UVCB.
IUPAC Name:
Fatty acids, coco, diesters and triesters with trimethylolpropane

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • 812-688-7
  • TMP ester
  • Trimethylolpropane tricocoate
  • Compositions

    Boundary Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    2-ethyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate
    EC Number:
    246-777-1
    EC Name:
    2-ethyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate
    CAS Number:
    25268-73-9
    Molecular formula:
    C42H80O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl laurate (non-preferred name)
    Constituent 2
    Chemical structure
    Reference substance name:
    2,2-bis[(dodecanoyloxy)methyl]butyl tetradecanoate
    Molecular formula:
    C44H84O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl tetradecanoate
    Constituent 3
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl dodecanoate
    Molecular formula:
    C30H58O5
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl dodecanoate
    Constituent 4
    Chemical structure
    Reference substance name:
    2,2-bis[(dodecanoyloxy)methyl]butyl hexadecanoate
    Molecular formula:
    C46H88O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl hexadecanoate
    Constituent 5
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C48
    Molecular formula:
    C48H90O6 and C48H92O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C48
    Constituent 6
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl tetradecanoate
    Molecular formula:
    C32H62O5
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl tetradecanoate
    Constituent 7
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C40
    Molecular formula:
    C40H76O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C40
    Constituent 8
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C34
    Molecular formula:
    C34H66O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C34
    Constituent 9
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C38H72O6
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 10
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C50
    Molecular formula:
    C50H94O6 and C50H96O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C50
    Constituent 11
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C36
    Molecular formula:
    C36H70O5 and C36H68O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C36
    Constituent 12
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C28
    Molecular formula:
    C28H54O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C28
    Constituent 13
    Chemical structure
    Reference substance name:
    2-(hydroxymethyl)-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C26H50O5
    IUPAC Name:
    2-(hydroxymethyl)-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 14
    Chemical structure
    Reference substance name:
    2,2-bis(hydroxymethyl)butyl dodecanoate
    Molecular formula:
    C18H36O4
    IUPAC Name:
    2,2-bis(hydroxymethyl)butyl dodecanoate
    Constituent 15
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C52
    Molecular formula:
    C52H98O6 and C52H100O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C52
    Constituent 16
    Reference substance name:
    Trimethylolpropane C20/C22 mono- or diester
    Molecular formula:
    C20H40O4 or C22H42O5
    IUPAC Name:
    Trimethylolpropane C20/C22 mono- or diester
    Constituent 17
    Chemical structure
    Reference substance name:
    2-[(decanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C36H68O6
    IUPAC Name:
    2-[(decanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 18
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C38
    Molecular formula:
    C38H72O5 and C38H74O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C38
    Constituent 19
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C54
    Molecular formula:
    C54H100O6; C54H102O6; C54H104O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C54

    Legal Entity Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    2-ethyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate
    EC Number:
    246-777-1
    EC Name:
    2-ethyl-2-[[(1-oxododecyl)oxy]methyl]propane-1,3-diyl dilaurate
    CAS Number:
    25268-73-9
    Molecular formula:
    C42H80O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl laurate (non-preferred name)
    Constituent 2
    Chemical structure
    Reference substance name:
    2,2-bis[(dodecanoyloxy)methyl]butyl tetradecanoate
    Molecular formula:
    C44H84O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl tetradecanoate
    Constituent 3
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl dodecanoate
    Molecular formula:
    C30H58O5
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl dodecanoate
    Constituent 4
    Chemical structure
    Reference substance name:
    2,2-bis[(dodecanoyloxy)methyl]butyl hexadecanoate
    Molecular formula:
    C46H88O6
    IUPAC Name:
    2,2-bis[(dodecanoyloxy)methyl]butyl hexadecanoate
    Constituent 5
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C48
    Molecular formula:
    C48H90O6 and C48H92O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C48
    Constituent 6
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl tetradecanoate
    Molecular formula:
    C32H62O5
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-(hydroxymethyl)butyl tetradecanoate
    Constituent 7
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C40
    Molecular formula:
    C40H76O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C40
    Constituent 8
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C34
    Molecular formula:
    C34H66O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C34
    Constituent 9
    Chemical structure
    Reference substance name:
    2-[(dodecanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C38H72O6
    IUPAC Name:
    2-[(dodecanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 10
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C50
    Molecular formula:
    C50H94O6 and C50H96O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C50
    Constituent 11
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C36
    Molecular formula:
    C36H70O5 and C36H68O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C36
    Constituent 12
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C28
    Molecular formula:
    C28H54O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C28
    Constituent 13
    Chemical structure
    Reference substance name:
    2-(hydroxymethyl)-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C26H50O5
    IUPAC Name:
    2-(hydroxymethyl)-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 14
    Chemical structure
    Reference substance name:
    2,2-bis(hydroxymethyl)butyl dodecanoate
    Molecular formula:
    C18H36O4
    IUPAC Name:
    2,2-bis(hydroxymethyl)butyl dodecanoate
    Constituent 15
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C52
    Molecular formula:
    C52H98O6 and C52H100O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C52
    Constituent 16
    Reference substance name:
    Trimethylolpropane C20/C22 mono- or diester
    Molecular formula:
    C20H40O4 or C22H42O5
    IUPAC Name:
    Trimethylolpropane C20/C22 mono- or diester
    Constituent 17
    Chemical structure
    Reference substance name:
    2-[(decanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Molecular formula:
    C36H68O6
    IUPAC Name:
    2-[(decanoyloxy)methyl]-2-[(octanoyloxy)methyl]butyl dodecanoate
    Constituent 18
    Reference substance name:
    Fatty acid diesters with trimethylolpropane C38
    Molecular formula:
    C38H72O5 and C38H74O5
    IUPAC Name:
    Fatty acid diesters with trimethylolpropane C38
    Constituent 19
    Reference substance name:
    Fatty acid triesters with trimethylolpropane C54
    Molecular formula:
    C54H100O6; C54H102O6; C54H104O6
    IUPAC Name:
    Fatty acid triesters with trimethylolpropane C54


    Constituent 1
    Reference substance name:
    C24H46O5
    Molecular formula:
    C24H46O5
    IUPAC Name:
    C24H46O5
    Constituent 2
    Reference substance name:
    C26H50O5
    Molecular formula:
    C26H50O5
    IUPAC Name:
    C26H50O5
    Constituent 3
    Reference substance name:
    C28H54O5
    Molecular formula:
    C28H54O5
    IUPAC Name:
    C28H54O5
    Constituent 4
    Reference substance name:
    C30H58O5
    Molecular formula:
    C30H58O5
    IUPAC Name:
    C30H58O5
    Constituent 5
    Reference substance name:
    C32H62O5
    Molecular formula:
    C32H62O5
    IUPAC Name:
    C32H62O5
    Constituent 6
    Reference substance name:
    C32H60O6
    Molecular formula:
    C32H60O6
    IUPAC Name:
    C32H60O6
    Constituent 7
    Reference substance name:
    C34H64O6
    Molecular formula:
    C34H64O6
    IUPAC Name:
    C34H64O6
    Constituent 8
    Reference substance name:
    C36H68O6
    Molecular formula:
    C36H68O6
    IUPAC Name:
    C36H68O6
    Constituent 9
    Reference substance name:
    C38H72O6
    Molecular formula:
    C38H72O6
    IUPAC Name:
    C38H72O6
    Constituent 10
    Reference substance name:
    C40H76O6
    Molecular formula:
    C40H76O6
    IUPAC Name:
    C40H76O6
    Constituent 11
    Reference substance name:
    C42H80O6
    Molecular formula:
    C42H80O6
    IUPAC Name:
    C42H80O6
    Constituent 12
    Reference substance name:
    Unknown
    IUPAC Name:
    Unknown
    State Form:
    liquid


    Constituent 1
    Reference substance name:
    trimethylolpropane di-caprate
    IUPAC Name:
    trimethylolpropane di-caprate
    Constituent 2
    Reference substance name:
    trimethylolpropane mono-laurate, mono-caprate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-caprate
    Constituent 3
    Reference substance name:
    trimethylolpropane di-laurate
    IUPAC Name:
    trimethylolpropane di-laurate
    Constituent 4
    Reference substance name:
    trimethylolpropane mono-caprate, di-caprylate
    IUPAC Name:
    trimethylolpropane mono-caprate, di-caprylate
    Constituent 5
    Reference substance name:
    trimethylolpropane mono-laurate, mono-myristate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-myristate
    Constituent 6
    Reference substance name:
    trimethylolpropane mono-laurate, di-caprylate
    IUPAC Name:
    trimethylolpropane mono-laurate, di-caprylate
    Constituent 7
    Reference substance name:
    trimethylolpropane mono-laurate, mono-caprate, mono-caprylate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-caprate, mono-caprylate
    Constituent 8
    Reference substance name:
    trimethylolpropane mono-laurate, mono-palmitate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-palmitate
    Constituent 9
    Reference substance name:
    trimethylolpropane mono-laurate, di-caprate
    IUPAC Name:
    trimethylolpropane mono-laurate, di-caprate
    Constituent 10
    Reference substance name:
    trimethylolpropane di-laurate, mono-caprate
    IUPAC Name:
    trimethylolpropane di-laurate, mono-caprate
    Constituent 11
    Reference substance name:
    trimethylolpropane tri-laurate
    IUPAC Name:
    trimethylolpropane tri-laurate
    Constituent 12
    Reference substance name:
    trimethylolpropane di-laurate, mono-myristate
    IUPAC Name:
    trimethylolpropane di-laurate, mono-myristate
    Constituent 13
    Reference substance name:
    trimethylolpropane di-laurate, mono-palmitate
    IUPAC Name:
    trimethylolpropane di-laurate, mono-palmitate
    Constituent 14
    Reference substance name:
    trimethylolpropane mono-laurate, mono-myristate, mono-palmitate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-myristate, mono-palmitate
    Constituent 15
    Reference substance name:
    trimethylolpropane mono-laurate, mono-myristate, mono-stearate
    IUPAC Name:
    trimethylolpropane mono-laurate, mono-myristate, mono-stearate
    Constituent 16
    Reference substance name:
    residuals
    IUPAC Name:
    residuals
    State Form:
    liquid


    Constituent 1
    Reference substance name:
    Fatty acids, coco, di- and triesters with trimethylolpropane
    Molecular formula:
    Not available as UVCB
    IUPAC Name:
    Fatty acids, coco, di- and triesters with trimethylolpropane
    Constituent 2
    Reference substance name:
    Fatty acids, coco, monoesters with trimethylolpropane
    Molecular formula:
    Not available as UVCB
    IUPAC Name:
    Fatty acids, coco, monoesters with trimethylolpropane
    Constituent 3
    Chemical structure
    Reference substance name:
    Propylidynetrimethanol
    EC Number:
    201-074-9
    EC Name:
    Propylidynetrimethanol
    CAS Number:
    77-99-6
    Molecular formula:
    C6H14O3
    IUPAC Name:
    2-ethyl-2-(hydroxymethyl)propane-1,3-diol
    Constituent 4
    Reference substance name:
    Fatty acids, C12-18
    EC Number:
    266-925-9
    EC Name:
    Fatty acids, C12-18
    CAS Number:
    67701-01-3
    Molecular formula:
    C12H24O2-C18H36O2
    IUPAC Name:
    Fatty acids, C12-18

    Composition(s) generated upon use

    Other types of composition(s)