Registration Dossier

Identification

Chemical structure
Display Name:
Reference substance 002
CAS Number:
53880-05-0
Molecular formula:
residual C12H18N2O2, otherwise C36H54N6O6 (trimer) and higher species

Type of substance

Composition:
UVCB
Origin:
organic

Other names

Trade names:
Desmodur Z 4470 BA
Desmodur Z 4470 MPA
Desmodur Z 4470 MPA/X
Desmodur Z 4470 SN
Tolonate IDT70S, IDT70B, IDT70MX, IDT70SB

Total tonnage band

Total range:
1 000 - 10 000 tonnes per annum

REACH

Registered as:
FULL
Submitted:
Joint Submission

Publication dates

First published:
03-Apr-2011
Last modified:
27-Jun-2019

Chemical safety assessment

Performed for this substance:
YES

Compositions open all close all

Type:
legal entity composition of the substance


Constituent 1
Chemical structure
Reference substance name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
EC Number:
267-445-2
EC Name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
CAS Number:
67873-91-0
Molecular formula:
C36H54N6O6
IUPAC Name:
1,3,5-tris[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 2
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C60H90N10O10
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 3
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C84H126N14O14
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 4
Chemical structure
Reference substance name:
exact identification is not feasible
Molecular formula:
C108H162N18O18
IUPAC Name:
exact identification is not feasible
Type:
legal entity composition of the substance


Constituent 1
Chemical structure
Reference substance name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
EC Number:
267-445-2
EC Name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
CAS Number:
67873-91-0
Molecular formula:
C36H54N6O6
IUPAC Name:
1,3,5-tris[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 2
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C60H90N10O10
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 3
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C84H126N14O14
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 4
Reference substance name:
not applicable
Molecular formula:
(C12H18N2O2)n>=9
IUPAC Name:
not applicable
Constituent 5
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
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
EC Number:
267-445-2
EC Name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
CAS Number:
67873-91-0
Molecular formula:
C36H54N6O6
IUPAC Name:
1,3,5-tris[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 2
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C60H90N10O10
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 3
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C84H126N14O14
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 4
Chemical structure
Reference substance name:
1-((5-(3,5-bis(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)-1,3,3-trimethylcyclohexyl)methyl)-3-(3-((3-((5-(3,5-bis(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)-1,3,3-trimethylcyclohexyl)methyl)-5-((3-isocyanato-3,5,5-trimethylcyclohexyl)methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)methyl)-3,5,5-trimethylcyclohexyl)-5-(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C108H162N18O18
IUPAC Name:
1-((5-(3,5-bis(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)-1,3,3-trimethylcyclohexyl)methyl)-3-(3-((3-((5-(3,5-bis(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)-1,3,3-trimethylcyclohexyl)methyl)-5-((3-isocyanato-3,5,5-trimethylcyclohexyl)methyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl)methyl)-3,5,5-trimethylcyclohexyl)-5-(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)-1,3,5-triazinane-2,4,6-trione
Constituent 5
Chemical structure
Reference substance name:
1. 2-ethylhexyl (3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)((3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamoyl)carbamate 2. 2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)carbamoyl(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamate 3. 2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)(((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)carbamoyl)carbamate 4.2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)((3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamoyl)carbamate
Molecular formula:
1.C32H54N4O5 2.C32H54N4O5 3.C32H54N4O5 4.C32H54N4O5
IUPAC Name:
1. 2-ethylhexyl (3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)((3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamoyl)carbamate 2. 2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)carbamoyl(3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamate 3. 2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)(((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)carbamoyl)carbamate 4.2-ethylhexyl ((5-isocyanato-1,3,3-trimethylcyclohexyl)methyl)((3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl)carbamoyl)carbamate
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
Type:
legal entity composition of the substance


Constituent 1
Chemical structure
Reference substance name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
EC Number:
267-445-2
EC Name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
CAS Number:
67873-91-0
Molecular formula:
C36H54N6O6
IUPAC Name:
1,3,5-tris[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 2
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C60H90N10O10
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 3
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C84H126N14O14
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 4
Chemical structure
Reference substance name:
exact identification is not feasible
Molecular formula:
C108H162N18O18
IUPAC Name:
exact identification is not feasible
Constituent 5
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
Type:
boundary composition of the substance


Constituent 1
Chemical structure
Reference substance name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
EC Number:
267-445-2
EC Name:
3,3',3''-[(1H,3H,5H)-2,4,6-trioxo-1,3,5-triazine-1,3,5-triyltris(methylene)]tris[3,5,5-trimethylcyclohexyl] triisocyanate
CAS Number:
67873-91-0
Molecular formula:
C36H54N6O6
IUPAC Name:
1,3,5-tris[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 2
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C60H90N10O10
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 3
Chemical structure
Reference substance name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Molecular formula:
C84H126N14O14
IUPAC Name:
1-[3-({3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}methyl)-3,5,5-trimethylcyclohexyl]-3-[(5-{3,5-bis[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl}-1,3,3-trimethylcyclohexyl)methyl]-5-[(5-isocyanato-1,3,3-trimethylcyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione
Constituent 4
Chemical structure
Reference substance name:
exact identification is not feasible
Molecular formula:
C108H162N18O18
IUPAC Name:
exact identification is not feasible
Constituent 5
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
Type:
legal entity composition of the substance


Constituent 1