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Identification

Chemical structure
Display Name:
Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, aluminium salt
EC Number:
272-939-6
EC Name:
Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, aluminium salt
CAS Number:
68921-42-6
Molecular formula:
C37H36N2O9S3.xAl
IUPAC Name:
dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, aluminium salt

Type of Substance

Composition:
multi-constituent substance
Origin:
organometallic

Substance Identifiers open all close all

  • Neelicert FD&C Blue 1 lake Neelicert FD&C Blue 1 Al lake Neelicert FD&C Blue 1 Al lake/LS/MS/HS Neelilake Brilliant Blue FCF Al Lake Neelilake Brilliant Blue FCF Lake Neelilake Brilliant Blue FCF Al Lake/LS/MS/HS
  • Compositions

    Boundary Composition(s) open all close all

    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    Aluminium, Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium.
    Molecular formula:
    C37H36N2O9S3.xAl
    IUPAC Name:
    Aluminium, Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium.
    Constituent 2
    Chemical structure
    Reference substance name:
    Aluminium hydroxide
    EC Number:
    244-492-7
    EC Name:
    Aluminium hydroxide
    CAS Number:
    21645-51-2
    Molecular formula:
    AlH3O3
    IUPAC Name:
    Aluminium hydroxide
    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    Aluminium hydroxide
    EC Number:
    244-492-7
    EC Name:
    Aluminium hydroxide
    CAS Number:
    21645-51-2
    Molecular formula:
    AlH3O3
    IUPAC Name:
    Aluminium hydroxide
    Constituent 2
    Chemical structure
    Reference substance name:
    Dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, disodium salt
    EC Number:
    223-339-8
    EC Name:
    Dihydrogen (ethyl)[4-[4-[ethyl(3-sulphonatobenzyl)]amino]-2'-sulphonatobenzhydrylidene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium, disodium salt
    CAS Number:
    3844-45-9
    Molecular formula:
    C37H34N2Na2O9S3
    IUPAC Name:
    disodium 2-({4-[ethyl(3-sulfonatobenzyl)amino]phenyl}{4-[ethyl(3-sulfonatobenzyl)iminio]cyclohexa-2,5-dien-1-ylidene}methyl)benzenesulfonate

    Legal Entity Composition(s) open all close all

    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    Aluminium, Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium.
    Molecular formula:
    C37H36N2O9S3.xAl
    IUPAC Name:
    Aluminium, Dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium.
    Constituent 2
    Chemical structure
    Reference substance name:
    Aluminium hydroxide
    EC Number:
    244-492-7
    EC Name:
    Aluminium hydroxide
    CAS Number:
    21645-51-2
    Molecular formula:
    AlH3O3
    IUPAC Name:
    Aluminium hydroxide
    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    dialuminium(3+) tris(3-({ethyl[(1E,4E)-4-[(4-{ethyl[(3-sulfophenyl)methyl]amino}phenyl)(2-sulfophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]azaniumyl}methyl)benzene-1-sulfonate)
    Molecular formula:
    C111H102Al2N6O27S9
    IUPAC Name:
    dialuminium(3+) tris(3-({ethyl[(1E,4E)-4-[(4-{ethyl[(3-sulfophenyl)methyl]amino}phenyl)(2-sulfophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]azaniumyl}methyl)benzene-1-sulfonate)
    Constituent 2
    Chemical structure
    Reference substance name:
    dialuminium(3+) tris(4-{ethyl[(3-sulfophenyl)methyl]amino}benzene-1-sulfonate)
    Molecular formula:
    C45H452N3O18S6
    IUPAC Name:
    dialuminium(3+) tris(4-{ethyl[(3-sulfophenyl)methyl]amino}benzene-1-sulfonate)
    Constituent 3
    Chemical structure
    Reference substance name:
    aluminium(3+) tris(2-formylbenzene-1-sulfonate)
    Molecular formula:
    C21H15AlO12S3
    IUPAC Name:
    aluminium(3+) tris(2-formylbenzene-1-sulfonate)
    Constituent 4
    Reference substance name:
    No IUPAC name
    IUPAC Name:
    No IUPAC name
    Constituent 5
    Chemical structure
    Reference substance name:
    Water
    EC Number:
    231-791-2
    EC Name:
    Water
    CAS Number:
    7732-18-5
    Molecular formula:
    H2O
    IUPAC Name:
    Water
    Constituent 6
    Chemical structure
    Reference substance name:
    Sodium chloride
    EC Number:
    231-598-3
    EC Name:
    Sodium chloride
    CAS Number:
    7647-14-5
    Molecular formula:
    NaCl
    IUPAC Name:
    Sodium chloride
    Constituent 7
    Chemical structure
    Reference substance name:
    Aluminium hydroxide
    EC Number:
    244-492-7
    EC Name:
    Aluminium hydroxide
    CAS Number:
    21645-51-2
    Molecular formula:
    AlH3O3
    IUPAC Name:
    Aluminium hydroxide
    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    Aluminium, dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium
    Molecular formula:
    C111H102Al2N6O27S9
    IUPAC Name:
    Aluminium, dihydrogen (ethyl)[4-[[4-[ethyl(3-sulphonatobenzyl)amino]phenyl](2-sulphonatophenyl)methylene]cyclohexa-2,5-dien-1-ylidene](3-sulphonatobenzyl)ammonium
    Constituent 2
    Chemical structure
    Reference substance name:
    Aluminium hydroxide
    EC Number:
    244-492-7
    EC Name:
    Aluminium hydroxide
    CAS Number:
    21645-51-2
    Molecular formula:
    AlH3O3
    IUPAC Name:
    Aluminium hydroxide