CHEBI:59605 - Disperse Blue 124

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Disperse Blue 124
ChEBI ID CHEBI:59605
Definition A monoazo compound consisting of diazene with a 5-nitrothiazol-2-yl group attached to one nitrogen and a substituted 4-aminophenyl group attached to the other; used as a dye standard for the assay of allergy-releasing dyes in textiles.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H19N5O4S
Net Charge 0
Average Mass 377.41800
Monoisotopic Mass 377.11578
InChI InChI=1S/C16H19N5O4S/c1-4-20(7-8-25-12(3)22)13-5-6-14(11(2)9-13)18-19-16-17-10-15(26-16)21(23)24/h5-6,9-10H,4,7-8H2,1-3H3
InChIKey HMAJVAFLGGPIPN-UHFFFAOYSA-N
SMILES CCN(CCOC(C)=O)c1ccc(N=Nc2ncc(s2)[N+]([O-])=O)c(C)c1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): hapten
Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
allergen
A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
Application(s): dye

View more via ChEBI Ontology
ChEBI Ontology
Outgoing Disperse Blue 124 (CHEBI:59605) has role allergen (CHEBI:50904)
Disperse Blue 124 (CHEBI:59605) has role dye (CHEBI:37958)
Disperse Blue 124 (CHEBI:59605) has role hapten (CHEBI:59174)
Disperse Blue 124 (CHEBI:59605) is a 1,3-thiazoles (CHEBI:38418)
Disperse Blue 124 (CHEBI:59605) is a monoazo compound (CHEBI:48959)
Disperse Blue 124 (CHEBI:59605) is a tertiary amine (CHEBI:32876)
IUPAC Name
2-(ethyl{3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl}amino)ethyl acetate
Synonyms Sources
2-(N-ethyl-4-((5-nitrothiazol-2-yl)azo)-m-toluidino)ethyl acetate ChEBI
C.I. Disperse Blue 124 ChEBI
Registry Numbers Types Sources
15141-18-1 CAS Registry Number ChemIDplus
61951-51-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
15462465 PubMed citation Europe PMC
21616561 PubMed citation Europe PMC
Last Modified
12 March 2019