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Identification

Chemical structure
Display Name:
3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomers, reaction products with 2-butanone oxime
EC Number:
500-287-7
EC Name:
3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomers, reaction products with 2-butanone oxime
CAS Number:
103170-26-9
Molecular formula:
>= C48H81N9O9 (IPDI-Isocyanurate n=3, 2-butanone oxime-blocked)
IUPAC Name:
3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomers, reaction products with 2-butanone oxime

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • BL IPDI Trimer MEKO
  • Desmodur BL 4265 SN

    • Compositions

    Boundary Composition(s) open all close all

    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    C48H81N9O9
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 2
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3-({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    C76H126N14O14
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3-({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 3
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    >= C104H171N19O19 (IPDI-Isocyanurate n=7, 2-butanone oxime-blocked)
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 4
    Chemical structure
    Reference substance name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    EC Number:
    268-398-0
    EC Name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    CAS Number:
    68083-48-7
    Molecular formula:
    C20H36N4O4
    IUPAC Name:
    butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    Constituent 5
    Chemical structure
    Reference substance name:
    Butanone oxime
    EC Number:
    202-496-6
    EC Name:
    Butanone oxime
    CAS Number:
    96-29-7
    Molecular formula:
    C4H9NO
    IUPAC Name:
    butan-2-one oxime
    Constituent 6
    Chemical structure
    Reference substance name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate
    EC Number:
    223-861-6
    EC Name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate
    CAS Number:
    4098-71-9
    Molecular formula:
    C12H18N2O2
    IUPAC Name:
    5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane

    Legal Entity Composition(s) open all close all

    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    C48H81N9O9
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 2
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3-({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    C76H126N14O14
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3-({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 3
    Chemical structure
    Reference substance name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Molecular formula:
    >= C104H171N19O19 (IPDI-Isocyanurate n=7, 2-butanone oxime-blocked)
    IUPAC Name:
    (Z)-(butan-2-ylidene)amino N-(3-{[3,5-bis({5-[3,5-bis({5-[({[(Z)-(butan-2-ylidene)amino]oxy}carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)carbamate
    Constituent 4
    Chemical structure
    Reference substance name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    EC Number:
    268-398-0
    EC Name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    CAS Number:
    68083-48-7
    Molecular formula:
    C20H36N4O4
    IUPAC Name:
    butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    Constituent 5
    Chemical structure
    Reference substance name:
    Butanone oxime
    EC Number:
    202-496-6
    EC Name:
    Butanone oxime
    CAS Number:
    96-29-7
    Molecular formula:
    C4H9NO
    IUPAC Name:
    butan-2-one oxime
    Constituent 6
    Chemical structure
    Reference substance name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate
    EC Number:
    223-861-6
    EC Name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate
    CAS Number:
    4098-71-9
    Molecular formula:
    C12H18N2O2
    IUPAC Name:
    5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=3, blocked with 2-butanone oxime
    Molecular formula:
    C48 H81 N9 O9
    IUPAC Name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=3, blocked with 2-butanone oxime
    Constituent 2
    Chemical structure
    Reference substance name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=5, blocked with 2-butanone oxime
    Molecular formula:
    C76 H126 N14 O14
    IUPAC Name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=5, blocked with 2-butanone oxime
    Constituent 3
    Reference substance name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=7 or higher, blocked with 2-butanone oxime
    Molecular formula:
    >= C104 H171 N19 O19
    IUPAC Name:
    3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomerization product (isocyanurate type), n=7 or higher, blocked with 2-butanone oxime
    Constituent 4
    Chemical structure
    Reference substance name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    EC Number:
    268-398-0
    EC Name:
    Butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    CAS Number:
    68083-48-7
    Molecular formula:
    C20H36N4O4
    IUPAC Name:
    butan-2-one O-[[[[1,3,3-trimethyl-5-[[[[(1-methylpropylidene)amino]oxy]carbonyl]amino]cyclohexyl]methyl]amino]carbonyl]oxime
    Constituent 5
    Chemical structure
    Reference substance name:
    Butanone oxime
    EC Number:
    202-496-6
    EC Name:
    Butanone oxime
    CAS Number:
    96-29-7
    Molecular formula:
    C4H9NO
    IUPAC Name:
    butan-2-one oxime


    Constituent 1
    Chemical structure
    Reference substance name:
    1,3-bis[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]urea
    Molecular formula:
    C23H44N6O5
    IUPAC Name:
    1,3-bis[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]urea
    Constituent 2
    Chemical structure
    Reference substance name:
    {[(E)-butan-2-ylideneamino]oxy}[({5-[({[(Z)-butan-2-ylideneamino]oxy}carbonyl) amino]-1,3,3-trimethylcyclohexyl}methyl)amino]methanone
    Molecular formula:
    C20H36N4O4
    IUPAC Name:
    {[(E)-butan-2-ylideneamino]oxy}[({5-[({[(Z)-butan-2-ylideneamino]oxy}carbonyl) amino]-1,3,3-trimethylcyclohexyl}methyl)amino]methanone
    Constituent 3
    Chemical structure
    Reference substance name:
    1,3-bis[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]-1,3-diazetidine-2,4-dione
    Molecular formula:
    C24H42N6O6
    IUPAC Name:
    1,3-bis[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]-1,3-diazetidine-2,4-dione
    Constituent 4
    Chemical structure
    Reference substance name:
    1,3,5-tris[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
    Molecular formula:
    C36H63N9O9
    IUPAC Name:
    1,3,5-tris[(5-{[(aminooxy)carbonyl]amino}-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
    Constituent 5