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Identification

Chemical structure
Display Name:
N-(6-{3-[6-(3-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide; N-[6-(3-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide; N-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
EC Number:
605-318-9
CAS Number:
163206-31-3
Molecular formula:
Not applicable (UVCB substance)
IUPAC Name:
N-(6-{3-[6-(3-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide; N-[6-(3-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-{6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide; N-{6-[3,5-bis({6-[(3,5-dimethyl-1H-pyrazole-1-carbonyl)amino]hexyl})-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

  • BAYHYTHERM 2782 XP
  • DESMODUR BL 3575 MPA/SN
  • DESMODUR PL 350
  • DESMODUR VP LS 2376/1
  • Desmodur VP LS 2253
  • Trixene DP9C/574

    • Compositions

    Boundary Composition(s) open all close all

    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    CAS Number:
    154031-76-2
    Molecular formula:
    C39H60N12O6
    IUPAC Name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 2
    Chemical structure
    Reference substance name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C60H92N18O10
    IUPAC Name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 3
    Chemical structure
    Reference substance name:
    N-(6-{3-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C81H124N24O14
    IUPAC Name:
    N-(6-{3-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 4
    Reference substance name:
    not applicable
    Molecular formula:
    >= C102H156N30O18
    IUPAC Name:
    not applicable
    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:
    Hexamethylene diisocyanate
    EC Number:
    212-485-8
    EC Name:
    Hexamethylene diisocyanate
    CAS Number:
    822-06-0
    Molecular formula:
    C8H12N2O2
    IUPAC Name:
    1,6-diisocyanatohexane

    Legal Entity Composition(s) open all close all

    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    CAS Number:
    154031-76-2
    Molecular formula:
    C39H60N12O6
    IUPAC Name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 2
    Chemical structure
    Reference substance name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C60H92N18O10
    IUPAC Name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 3
    Chemical structure
    Reference substance name:
    N-(6-{3-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C81H124N24O14
    IUPAC Name:
    N-(6-{3-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl}hexyl)-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 4
    Reference substance name:
    not applicable
    Molecular formula:
    >= C102H156N30O18
    IUPAC Name:
    not applicable
    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:
    Hexamethylene diisocyanate
    EC Number:
    212-485-8
    EC Name:
    Hexamethylene diisocyanate
    CAS Number:
    822-06-0
    Molecular formula:
    C8H12N2O2
    IUPAC Name:
    1,6-diisocyanatohexane
    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    58.2% {1 HDI trimer + 3 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    58.2% {1 HDI trimer + 3 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 2
    Chemical structure
    Reference substance name:
    14.0% {2 ‘’HDI-bridged’’ HDI trimer + 4 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    14.0% {2 ‘’HDI-bridged’’ HDI trimer + 4 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 3
    Chemical structure
    Reference substance name:
    3.9% {3 ‘’HDI-bridged’’ HDI trimers + 5 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    3.9% {3 ‘’HDI-bridged’’ HDI trimers + 5 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 4
    Chemical structure
    Reference substance name:
    3.8% {HDI dimer ‘’less carbonyl’’ + 3 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    3.8% {HDI dimer ‘’less carbonyl’’ + 3 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 5
    Chemical structure
    Reference substance name:
    3.1% {HDI dimer + 1 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    3.1% {HDI dimer + 1 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 6
    Chemical structure
    Reference substance name:
    2.1% {Unidentified C72H112N22O10 isomer w/ 5 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    2.1% {Unidentified C72H112N22O10 isomer w/ 5 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 7
    Chemical structure
    Reference substance name:
    1.9% {2 ‘’HDI-bridged’’ HDI trimers ‘’less carbonyl + 4 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    1.9% {2 ‘’HDI-bridged’’ HDI trimers ‘’less carbonyl + 4 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 8
    Chemical structure
    Reference substance name:
    1.0% {4 ‘’HDI-bridged’’ HDI trimers + 6 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    1.0% {4 ‘’HDI-bridged’’ HDI trimers + 6 DMP groups} component of Hexane, 1,6-diisocyanato-, homopolymer, 3,5-dimethyl-1Hpyrazole-blocked
    Constituent 9
    Chemical structure
    Reference substance name:
    Not applicable for UVCB substances
    Molecular formula:
    Not applicable for UVCB substances
    IUPAC Name:
    Not applicable for UVCB substances
    State Form:
    solid: bulk


    Constituent 1
    Chemical structure
    Reference substance name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan- 1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C39H60N12O6
    IUPAC Name:
    N-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan- 1-yl]hexyl}-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Constituent 2
    Chemical structure
    Reference substance name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide
    Molecular formula:
    C60H92N18O10
    IUPAC Name:
    N-[6-(3-{6-[3,5-bis(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]hexyl}-5-(6-{[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]amino}hexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)hexyl]-3,5-dimethyl-1H-pyrazole-1-carboxamide