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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Identification

Chemical structure
Display Name:
3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomers, reaction products with 3,5-dimethyl-1H-pyrazole
EC Number:
606-423-2
CAS Number:
200295-52-9
Molecular formula:
>= C51H78N12O6 (IPDI-Isocyanurate n=3, blocked with 3,5-dimethylpyrazole)
IUPAC Name:
3-Isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, oligomers, reaction products with 3,5-dimethyl-1H-pyrazole

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • 200295-52-9
  • Trixene DP9C/573
  • 1H-Pyrazole, 3,5-dimethyl-, reaction products with 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane trimer
    (No other type specified)

    Compositions

    Boundary Composition(s) open all close all

    State Form:
    solid: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    N-(3-{[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C51H78N12O6
    IUPAC Name:
    N-(3-{[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 2
    Chemical structure
    Reference substance name:
    N-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-5-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-5-({1,3,3-trimethyl-5-[(5-methyl-1H-pyrazole-1-carbonyl)amino]cyclohexyl}methyl)-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C79H120N18O10
    IUPAC Name:
    N-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-5-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-5-({1,3,3-trimethyl-5-[(5-methyl-1H-pyrazole-1-carbonyl)amino]cyclohexyl}methyl)-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 3
    Chemical structure
    Reference substance name:
    N-(3-{[3-(3-{[3-({5-[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C109H166N24O14
    IUPAC Name:
    N-(3-{[3-(3-{[3-({5-[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 4
    Chemical structure
    Reference substance name:
    N-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    CAS Number:
    154031-74-0
    Molecular formula:
    C22H34N6O2
    IUPAC Name:
    N-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 5
    Chemical structure
    Reference substance name:
    3,5-dimethylpyrazole
    EC Number:
    200-657-5
    EC Name:
    3,5-dimethylpyrazole
    CAS Number:
    67-51-6
    Molecular formula:
    C5H8N2
    IUPAC Name:
    3,5-dimethyl-1H-pyrazole
    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



    Constituent 1
    Chemical structure
    Reference substance name:
    N-(3-{[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C51H78N12O6
    IUPAC Name:
    N-(3-{[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 2
    Chemical structure
    Reference substance name:
    N-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-5-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-5-({1,3,3-trimethyl-5-[(5-methyl-1H-pyrazole-1-carbonyl)amino]cyclohexyl}methyl)-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C79H120N18O10
    IUPAC Name:
    N-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-5-(3-{[3-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-5-({1,3,3-trimethyl-5-[(5-methyl-1H-pyrazole-1-carbonyl)amino]cyclohexyl}methyl)-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 3
    Chemical structure
    Reference substance name:
    N-(3-{[3-(3-{[3-({5-[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C109H166N24O14
    IUPAC Name:
    N-(3-{[3-(3-{[3-({5-[3,5-bis({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-1,3,3-trimethylcyclohexyl}methyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-5-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]methyl}-3,5,5-trimethylcyclohexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 4
    Chemical structure
    Reference substance name:
    N-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    CAS Number:
    154031-74-0
    Molecular formula:
    C22H34N6O2
    IUPAC Name:
    N-({5-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]-1,3,3-trimethylcyclohexyl}methyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 5
    Chemical structure
    Reference substance name:
    3,5-dimethylpyrazole
    EC Number:
    200-657-5
    EC Name:
    3,5-dimethylpyrazole
    CAS Number:
    67-51-6
    Molecular formula:
    C5H8N2
    IUPAC Name:
    3,5-dimethyl-1H-pyrazole
    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: particulate/powder


    Constituent 1
    Chemical structure
    Reference substance name:
    1 IPDI trimer + 3 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C51H78N12O6
    IUPAC Name:
    1 IPDI trimer + 3 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 2
    Chemical structure
    Reference substance name:
    2 “IPDI-bridged” IPDI trimers + 4 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C80H122N18O10
    IUPAC Name:
    2 “IPDI-bridged” IPDI trimers + 4 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 3
    Chemical structure
    Reference substance name:
    3 IPDI-bridged” IPDI trimers + 5 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C109H166N24O14
    IUPAC Name:
    3 IPDI-bridged” IPDI trimers + 5 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 4
    Chemical structure
    Reference substance name:
    4 IPDI-bridged” IPDI trimers + 6 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C138H210N30O18
    IUPAC Name:
    4 IPDI-bridged” IPDI trimers + 6 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 5
    Chemical structure
    Reference substance name:
    IPDI monomer + 2 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C22H34N6O2
    IUPAC Name:
    IPDI monomer + 2 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 6
    Chemical structure
    Reference substance name:
    5 "IPDI-bridged” IPDI trimers + 7 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C167H254N36O22
    IUPAC Name:
    5 "IPDI-bridged” IPDI trimers + 7 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 7
    Chemical structure
    Reference substance name:
    6 "IPDI-bridged” IPDI trimers + 8 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Molecular formula:
    C196H298N42O26
    IUPAC Name:
    6 "IPDI-bridged” IPDI trimers + 8 DMP groups component of Cyclohexane, 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-, homopolymer, 3,5-dimethyl-1H-pyrazole-blocked
    Constituent 8
    Chemical structure
    Reference substance name:
    Ethyl acetate
    EC Number:
    205-500-4
    EC Name:
    Ethyl acetate
    CAS Number:
    141-78-6
    Molecular formula:
    C4H8O2
    IUPAC Name:
    Ethyl acetate

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