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Diss Factsheets

Identification

Chemical structure
Display Name:
Butanedioic acid, sulfo-, 4-[2-[(2-hydroxyethyl)amino]ethyl] ester, N-C18-unsatd. acyl derivs., disodium salts
EC Number:
308-072-8
EC Name:
Butanedioic acid, sulfo-, 4-[2-[(2-hydroxyethyl)amino]ethyl] ester, N-C18-unsatd. acyl derivs., disodium salts
CAS Number:
97862-28-7
Molecular formula:
Not applicable: UVCB substance
IUPAC Name:
disodium 4-{2-[(9Z)-N-(2-hydroxyethyl)octadec-9-enamido]ethoxy}-4-oxo-3-sulfonatobutanoate

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers

Compositions

Boundary Composition(s)

Legal Entity Composition(s) open all close all



Constituent 1
Chemical structure
Reference substance name:
Butanedioic acid, sulfo-, 4-[2-[(2-hydroxyethyl)amino]ethyl] ester, N-C18-unsatd. acyl derivs., disodium salts
EC Number:
308-072-8
EC Name:
Butanedioic acid, sulfo-, 4-[2-[(2-hydroxyethyl)amino]ethyl] ester, N-C18-unsatd. acyl derivs., disodium salts
CAS Number:
97862-28-7
Molecular formula:
Not applicable: UVCB substance
IUPAC Name:
disodium 4-{2-[(9Z)-N-(2-hydroxyethyl)octadec-9-enamido]ethoxy}-4-oxo-3-sulfonatobutanoate
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(Z)-N,N-bis(2-hydroxyethyl)octadec-9-enamide
Molecular formula:
C22H43NO3
IUPAC Name:
(Z)-N,N-bis(2-hydroxyethyl)octadec-9-enamide
Constituent 2
Chemical structure
Reference substance name:
C18 fatty acids
Molecular formula:
C18H34o2
IUPAC Name:
C18 fatty acids
Constituent 3
Chemical structure
Reference substance name:
disodium;4-[2-[2-hydroxyethyl(octadecanoyl)amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Molecular formula:
C26H47NO9S.2Na
IUPAC Name:
disodium;4-[2-[2-hydroxyethyl(octadecanoyl)amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Constituent 4
Chemical structure
Reference substance name:
disodium;4-[2-[2-hydroxyethyl-[(Z)-octadec-9-enoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Molecular formula:
C26H45NO9S.1Na
IUPAC Name:
disodium;4-[2-[2-hydroxyethyl-[(Z)-octadec-9-enoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Constituent 5
Chemical structure
Reference substance name:
disodium;4-[2-[2-hydroxyethyl-[(9Z,12Z)-octadeca-9,12-dienoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Molecular formula:
C26H43NO9S.2Na
IUPAC Name:
disodium;4-[2-[2-hydroxyethyl-[(9Z,12Z)-octadeca-9,12-dienoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Constituent 6
Chemical structure
Reference substance name:
disodium;4-[2-[2-hydroxyethyl-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
Molecular formula:
C26H43NO9S.2Na
IUPAC Name:
disodium;4-[2-[2-hydroxyethyl-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]ethoxy]-4-oxo-3-sulfonato-butanoate
State Form:
solid: particulate/powder


Constituent 1
Chemical structure
Reference substance name:
Sulphosuccinic acid
EC Number:
225-898-3
EC Name:
Sulphosuccinic acid
CAS Number:
5138-18-1
Molecular formula:
C4H6O7S
IUPAC Name:
2-sulfobutanedioic acid
Constituent 2
Chemical structure
Reference substance name:
4-(2-((2E,8E,16E)-N-(2-((3-carboxypropanoyl)oxy)ethyl)octadeca-2,8,16-trienamido)ethoxy)-2-sulfopent-4-enoic acid
Molecular formula:
C30H47NO15S2
IUPAC Name:
4-(2-((2E,8E,16E)-N-(2-((3-carboxypropanoyl)oxy)ethyl)octadeca-2,8,16-trienamido)ethoxy)-2-sulfopent-4-enoic acid
Constituent 3
Chemical structure
Reference substance name:
4-(2-((2E,8E)-N-(2-((3-carboxy-2-sulfopropanoyl)oxy)ethyl)octadeca-2,8-dienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C30H49NO15S2
IUPAC Name:
4-(2-((2E,8E)-N-(2-((3-carboxy-2-sulfopropanoyl)oxy)ethyl)octadeca-2,8-dienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 4
Chemical structure
Reference substance name:
(E)-4-(2-(N-(2-((3-carboxy-2-sulfopropanoyl)oxy)ethyl)octadec-8-enamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C30H51NO15S2
IUPAC Name:
(E)-4-(2-(N-(2-((3-carboxy-2-sulfopropanoyl)oxy)ethyl)octadec-8-enamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 5
Chemical structure
Reference substance name:
4-(2-((2E,8E,16E)-N-(2-hydroxyethyl)octadeca-2,8,16-trienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C26H43NO9S
IUPAC Name:
4-(2-((2E,8E,16E)-N-(2-hydroxyethyl)octadeca-2,8,16-trienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 6
Chemical structure
Reference substance name:
4-(2-((2E,8E)-N-(2-hydroxyethyl)octadeca-2,8-dienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C26H45NO9S
IUPAC Name:
4-(2-((2E,8E)-N-(2-hydroxyethyl)octadeca-2,8-dienamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 7
Chemical structure
Reference substance name:
(E)-4-(2-(N-(2-hydroxyethyl)octadec-8-enamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C26H47NO9S
IUPAC Name:
(E)-4-(2-(N-(2-hydroxyethyl)octadec-8-enamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 8
Chemical structure
Reference substance name:
4-(2-(N-(2-hydroxyethyl)palmitamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Molecular formula:
C24H45NO9S
IUPAC Name:
4-(2-(N-(2-hydroxyethyl)palmitamido)ethoxy)-4-oxo-2-sulfobutanoic acid
Constituent 9
Chemical structure
Reference substance name:
(2E,8E,16E)-N,N-bis(2-hydroxyethyl)octadeca-2,8,16-trienamide
Molecular formula:
C22H39NO3
IUPAC Name:
(2E,8E,16E)-N,N-bis(2-hydroxyethyl)octadeca-2,8,16-trienamide
Constituent 10
Chemical structure
Reference substance name:
(2E,8E)-N,N-bis(2-hydroxyethyl)octadeca-2,8-dienamide
Molecular formula:
C22H41NO3
IUPAC Name:
(2E,8E)-N,N-bis(2-hydroxyethyl)octadeca-2,8-dienamide
Constituent 11
Chemical structure
Reference substance name:
(E)-N,N-bis(2-hydroxyethyl)octadec-8-enamide
Molecular formula:
C22H43NO3
IUPAC Name:
(E)-N,N-bis(2-hydroxyethyl)octadec-8-enamide
Constituent 12
Chemical structure
Reference substance name:
2-((2-(((3E,9E,17E)-nonadeca-1,3,9,17-tetraen-2-yl)oxy)ethyl)amino)ethan-1-ol
Molecular formula:
C23H41NO2
IUPAC Name:
2-((2-(((3E,9E,17E)-nonadeca-1,3,9,17-tetraen-2-yl)oxy)ethyl)amino)ethan-1-ol
Constituent 13
Chemical structure
Reference substance name:
2-((2-(((3E,9E)-nonadeca-1,3,9-trien-2-yl)oxy)ethyl)amino)ethan-1-ol
Molecular formula:
C23H43NO2
IUPAC Name:
2-((2-(((3E,9E)-nonadeca-1,3,9-trien-2-yl)oxy)ethyl)amino)ethan-1-ol
Constituent 14