Basic information
- Standard SMILES
CC(=O)C(N=Nc1ccc(-c2ccc(N=NC(C(C)=O)C(=O)Nc3ccc(C)cc3C)c(Cl)c2)cc1Cl)C(=O)Nc1ccc(C)cc1C- InChIKey
IAFBRPFISOTXSO-UHFFFAOYSA-N- Molecular formula
- C36H34Cl2N6O4
- Average molar mass
- 685.6 g/mol
- Monoisotopic mass
- 684.201859
Names & identifiers
- Preferred name
- Diarylide Yellow
- IUPAC
- 2-[[2-chloro-4-[3-chloro-4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2,4-dimethylphenyl)-3-oxobutanamide
- English name
- Pigment Yellow 13
- Molecular formula
- C36H34Cl2N6O4
- Molecular weight
- 685.6
Names & synonyms
5102-83-0Diarylide YellowMonolite Yellow GLHelio Fast Yellow GRFLight Yellow JBRKromon Yellow GXRVynamon Yellow GREBenzidine Yellow GEHostaperm Yellow GRPermanent Yellow GRIrgalite Yellow BAWMonolite Yellow GLA
Show more names
YELLOW 13Pigment Yellow 13C.I. Pigment Yellow 13Pigment yellow 13 (C.I. 21100)KI205huangfenC.I. 21100C.I.P.Y.13lianbenangrlianbenanhang
Vynamon Yellow GRESIrgaplast Yellow IRSIrgalite Yellow BAWXElkon Fast Yellow GRVulcan Fast Yellow GRHelio Fast Yellow GRNLatexol Fast Yellow JRRubber Fast Yellow GRA
Database identifiers
- CAS
5102-83-0- PubChem CID
- 73462
- UNII
- O8RYS681QI
- Nikkaji
- J35.634D
Properties
Computed structural properties
- XLogP
- 9.5
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,110
Physicochemical properties
- Melting point
- 312 · 312-320°C
- Boiling point
- 799.5 · 799.5±60.0 °C(Predicted)
- Density
- 1.29 · 1.29
- refractive index
- 1.735 · 1.7350 (estimate)
- pka
- 0.72 · 0.72±0.59(Predicted)
- form
- Solid:nanomaterial
- Water Solubility
- 0.1 g/100 · <0.1 g/100 mL at 22 ºC
- Cosmetics Ingredients Functions
- COLORANTHAIR DYEING
- LogP
- 1.8 at · 1.8 at 24℃ and pH7
- CAS DataBase Reference
- 5102 · 5102-83-0(CAS DataBase Reference)
- EWG's Food Scores
- 2 · 2-5
- FDA UNII
- 8 RYS681QI · O8RYS681QI
- EPA Substance Registry System
- 13 · C.I. Pigment Yellow 13 (5102-83-0)
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety data
- tsca
- TSCA listed
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
Use ClassificationCosmetics -> Hair dyeing; Cosmetic colorant
Applications
UsesPigment yellow 13 (CAS# 5102-83-0) is a pigment used as a color stabilizer of wood flour/polypropylene composites.
Upstream & downstream products
Upstream raw materials
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