Registration Dossier

Identification

Display Name:
Acid Catalysed Reaction Products of 3,7-dimethyl-2,6-octadienal in the presence of ethanol
EC Number:
947-660-4
IUPAC Name:
Acid Catalysed Reaction Products of 3,7-dimethyl-2,6-octadienal in the presence of ethanol

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • 291-768-8
  • 147060-73-9
  • 90480-35-6
  • CITRAL DIETHYL ACETAL
  • CITRAL, ACID ISOMERIZED
  • Citrathal Conc S
  • Citrathal Concentrate S TW
  • Citrathal Concentrate TW
  • Citrathal R
  • Citrathal Tech
  • Compositions

    Boundary Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    p-cymene
    EC Number:
    202-796-7
    EC Name:
    p-cymene
    CAS Number:
    99-87-6
    Molecular formula:
    C10H14
    IUPAC Name:
    1-isopropyl-4-methylbenzene
    Constituent 2
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    p,α-dimethylstyrene
    EC Number:
    214-795-9
    EC Name:
    p,α-dimethylstyrene
    CAS Number:
    1195-32-0
    Molecular formula:
    C10H12
    IUPAC Name:
    1-isopropenyl-4-methylbenzene
    Constituent 4
    Chemical structure
    Reference substance name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    CAS Number:
    1686-20-0
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    Constituent 5
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
    Constituent 6
    Chemical structure
    Reference substance name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    CAS Number:
    68279-51-6
    Molecular formula:
    C12H18O
    IUPAC Name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    Constituent 7
    Chemical structure
    Reference substance name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    CAS Number:
    65293-09-6
    Molecular formula:
    C12H16O
    IUPAC Name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    Constituent 8
    Chemical structure
    Reference substance name:
    2,3-dihydrotoluene
    EC Number:
    216-071-8
    EC Name:
    2,3-dihydrotoluene
    CAS Number:
    1489-56-1
    Molecular formula:
    C7H10
    IUPAC Name:
    1-methylcyclohexa-1,3-diene
    Constituent 9
    Chemical structure
    Reference substance name:
    p-mentha-1,3-diene
    EC Number:
    202-795-1
    EC Name:
    p-mentha-1,3-diene
    CAS Number:
    99-86-5
    Molecular formula:
    C10H16
    IUPAC Name:
    1-methyl-4-propan-2-ylcyclohexa-1,3-diene
    Constituent 10
    Chemical structure
    Reference substance name:
    (E)-3,7-dimethylocta-2,6-dienal
    EC Number:
    205-476-5
    EC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    141-27-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    Constituent 11
    Chemical structure
    Reference substance name:
    (Z)-3,7-dimethylocta-2,6-dienal
    EC Number:
    203-379-2
    EC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    106-26-3
    Molecular formula:
    C10H16O
    IUPAC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    Constituent 12
    Chemical structure
    Reference substance name:
    α,α,4-trimethylbenzyl alcohol
    EC Number:
    214-817-7
    EC Name:
    α,α,4-trimethylbenzyl alcohol
    CAS Number:
    1197-01-9
    Molecular formula:
    C10H14O
    IUPAC Name:
    2-(4-methylphenyl)propan-2-ol
    Constituent 13
    Reference substance name:
    likely hydrocarbons and oxygenated hydrocarbons
    IUPAC Name:
    likely hydrocarbons and oxygenated hydrocarbons

    Legal Entity Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    p-cymene
    EC Number:
    202-796-7
    EC Name:
    p-cymene
    CAS Number:
    99-87-6
    Molecular formula:
    C10H14
    IUPAC Name:
    1-isopropyl-4-methylbenzene
    Constituent 2
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    p,α-dimethylstyrene
    EC Number:
    214-795-9
    EC Name:
    p,α-dimethylstyrene
    CAS Number:
    1195-32-0
    Molecular formula:
    C10H12
    IUPAC Name:
    1-isopropenyl-4-methylbenzene
    Constituent 4
    Chemical structure
    Reference substance name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    CAS Number:
    1686-20-0
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    Constituent 5
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
    Constituent 6
    Chemical structure
    Reference substance name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    CAS Number:
    68279-51-6
    Molecular formula:
    C12H18O
    IUPAC Name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    Constituent 7
    Chemical structure
    Reference substance name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    CAS Number:
    65293-09-6
    Molecular formula:
    C12H16O
    IUPAC Name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    Constituent 8
    Chemical structure
    Reference substance name:
    2,3-dihydrotoluene
    EC Number:
    216-071-8
    EC Name:
    2,3-dihydrotoluene
    CAS Number:
    1489-56-1
    Molecular formula:
    C7H10
    IUPAC Name:
    1-methylcyclohexa-1,3-diene
    Constituent 9
    Chemical structure
    Reference substance name:
    p-mentha-1,3-diene
    EC Number:
    202-795-1
    EC Name:
    p-mentha-1,3-diene
    CAS Number:
    99-86-5
    Molecular formula:
    C10H16
    IUPAC Name:
    1-methyl-4-propan-2-ylcyclohexa-1,3-diene
    Constituent 10
    Chemical structure
    Reference substance name:
    (E)-3,7-dimethylocta-2,6-dienal
    EC Number:
    205-476-5
    EC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    141-27-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    Constituent 11
    Chemical structure
    Reference substance name:
    (Z)-3,7-dimethylocta-2,6-dienal
    EC Number:
    203-379-2
    EC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    106-26-3
    Molecular formula:
    C10H16O
    IUPAC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    Constituent 12
    Chemical structure
    Reference substance name:
    α,α,4-trimethylbenzyl alcohol
    EC Number:
    214-817-7
    EC Name:
    α,α,4-trimethylbenzyl alcohol
    CAS Number:
    1197-01-9
    Molecular formula:
    C10H14O
    IUPAC Name:
    2-(4-methylphenyl)propan-2-ol
    Constituent 13
    Reference substance name:
    likely hydrocarbons and oxygenated hydrocarbons
    IUPAC Name:
    likely hydrocarbons and oxygenated hydrocarbons
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    p-cymene
    EC Number:
    202-796-7
    EC Name:
    p-cymene
    CAS Number:
    99-87-6
    Molecular formula:
    C10H14
    IUPAC Name:
    1-isopropyl-4-methylbenzene
    Constituent 2
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    p,α-dimethylstyrene
    EC Number:
    214-795-9
    EC Name:
    p,α-dimethylstyrene
    CAS Number:
    1195-32-0
    Molecular formula:
    C10H12
    IUPAC Name:
    1-isopropenyl-4-methylbenzene
    Constituent 4
    Chemical structure
    Reference substance name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    CAS Number:
    1686-20-0
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    Constituent 5
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
    Constituent 6
    Chemical structure
    Reference substance name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    CAS Number:
    68279-51-6
    Molecular formula:
    C12H18O
    IUPAC Name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    Constituent 7
    Chemical structure
    Reference substance name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    CAS Number:
    65293-09-6
    Molecular formula:
    C12H16O
    IUPAC Name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    Constituent 8
    Chemical structure
    Reference substance name:
    2,3-dihydrotoluene
    EC Number:
    216-071-8
    EC Name:
    2,3-dihydrotoluene
    CAS Number:
    1489-56-1
    Molecular formula:
    C7H10
    IUPAC Name:
    1-methylcyclohexa-1,3-diene
    Constituent 9
    Chemical structure
    Reference substance name:
    p-mentha-1,3-diene
    EC Number:
    202-795-1
    EC Name:
    p-mentha-1,3-diene
    CAS Number:
    99-86-5
    Molecular formula:
    C10H16
    IUPAC Name:
    1-methyl-4-propan-2-ylcyclohexa-1,3-diene
    Constituent 10
    Chemical structure
    Reference substance name:
    (E)-3,7-dimethylocta-2,6-dienal
    EC Number:
    205-476-5
    EC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    141-27-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    Constituent 11
    Chemical structure
    Reference substance name:
    (Z)-3,7-dimethylocta-2,6-dienal
    EC Number:
    203-379-2
    EC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    106-26-3
    Molecular formula:
    C10H16O
    IUPAC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    Constituent 12
    Chemical structure
    Reference substance name:
    α,α,4-trimethylbenzyl alcohol
    EC Number:
    214-817-7
    EC Name:
    α,α,4-trimethylbenzyl alcohol
    CAS Number:
    1197-01-9
    Molecular formula:
    C10H14O
    IUPAC Name:
    2-(4-methylphenyl)propan-2-ol
    Constituent 13
    Reference substance name:
    Likely hydrocarbons and oxygenated hydrocarbons
    IUPAC Name:
    Likely hydrocarbons and oxygenated hydrocarbons
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    p-cymene
    EC Number:
    202-796-7
    EC Name:
    p-cymene
    CAS Number:
    99-87-6
    Molecular formula:
    C10H14
    IUPAC Name:
    1-isopropyl-4-methylbenzene
    Constituent 2
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 3
    Chemical structure
    Reference substance name:
    p,α-dimethylstyrene
    EC Number:
    214-795-9
    EC Name:
    p,α-dimethylstyrene
    CAS Number:
    1195-32-0
    Molecular formula:
    C10H12
    IUPAC Name:
    1-isopropenyl-4-methylbenzene
    Constituent 4
    Chemical structure
    Reference substance name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    CAS Number:
    1686-20-0
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohexa-2,4-dien-1-yl)propan-2-ol
    Constituent 5
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
    Constituent 6
    Chemical structure
    Reference substance name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    CAS Number:
    68279-51-6
    Molecular formula:
    C12H18O
    IUPAC Name:
    Benzene, 1-​(1-​ethoxy-​1-​methylethyl)​-​4-​methyl-
    Constituent 7
    Chemical structure
    Reference substance name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    CAS Number:
    65293-09-6
    Molecular formula:
    C12H16O
    IUPAC Name:
    2-(4-methylenecyclohex-2-en-1-yl)propan-2-ol
    Constituent 8
    Chemical structure
    Reference substance name:
    2,3-dihydrotoluene
    EC Number:
    216-071-8
    EC Name:
    2,3-dihydrotoluene
    CAS Number:
    1489-56-1
    Molecular formula:
    C7H10
    IUPAC Name:
    1-methylcyclohexa-1,3-diene
    Constituent 9
    Chemical structure
    Reference substance name:
    p-mentha-1,3-diene
    EC Number:
    202-795-1
    EC Name:
    p-mentha-1,3-diene
    CAS Number:
    99-86-5
    Molecular formula:
    C10H16
    IUPAC Name:
    1-methyl-4-propan-2-ylcyclohexa-1,3-diene
    Constituent 10
    Chemical structure
    Reference substance name:
    (E)-3,7-dimethylocta-2,6-dienal
    EC Number:
    205-476-5
    EC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    141-27-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    (E)-3,7-dimethylocta-2,6-dienal
    Constituent 11
    Chemical structure
    Reference substance name:
    (Z)-3,7-dimethylocta-2,6-dienal
    EC Number:
    203-379-2
    EC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    CAS Number:
    106-26-3
    Molecular formula:
    C10H16O
    IUPAC Name:
    (Z)-3,7-dimethylocta-2,6-dienal
    Constituent 12
    Chemical structure
    Reference substance name:
    α,α,4-trimethylbenzyl alcohol
    EC Number:
    214-817-7
    EC Name:
    α,α,4-trimethylbenzyl alcohol
    CAS Number:
    1197-01-9
    Molecular formula:
    C10H14O
    IUPAC Name:
    2-(4-methylphenyl)propan-2-ol
    Constituent 13
    Reference substance name:
    Unknown constituents present at >=1% by GC
    IUPAC Name:
    Unknown constituents present at >=1% by GC
    Constituent 14
    Reference substance name:
    Unknown constituents present at <1% by GC
    IUPAC Name:
    Unknown constituents present at <1% by GC

    Composition(s) generated upon use

    Other types of composition(s)