Reactive Yellow 3

Base Information

• Chemical Name: Reactive Yellow 3
• CAS No.: 6539-67-9
• Deprecated CAS: 12238-13-0,12239-47-3,131595-01-2,66554-67-4,75027-01-9,85256-09-3,12239-47-3,131595-01-2,66554-67-4,75027-01-9,85256-09-3
• Molecular Formula: C21H17ClN8O7S2
• Molecular Weight: 592.99208
• European Community (EC) Number: 229-453-4
• DSSTox Substance ID: DTXSID1064407
• Nikkaji Number: J21.684D
• Mol file: 6539-67-9.mol

Synonyms:Reactive Yellow 3;6539-67-9;C.I. Reactive Yellow 3;EINECS 229-453-4;3-[[2-acetamido-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]naphthalene-1,5-disulfonic acid;1,5-Naphthalenedisulfonic acid, 3-[[2-(acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]azo]-;1,5-Naphthalenedisulfonic acid,3-[[2-(acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]azo]-;1,5-Naphthalenedisulfonic acid, 3-((2-(acetylamino)-4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)phenyl)azo)-;1,5-Naphthalenedisulfonic acid, 3-(2-(2-(acetylamino)-4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)phenyl)diazenyl)-;3-((4-(4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-acetylamino)phenylazo-1,5-naphthalenedisulfonic acid;C.I.Reactive Yellow 3;C21H17ClN8O7S2;3-((2-(Acetylamino)-4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)phenyl)azo)naphthalene-1,5-disulphonic acid;3-[[2-(acetylamino)-4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]phenyl]azo]naphthalene-1,5-disulphonic acid;SCHEMBL3644496;DTXSID1064407;MFCD00800437;AKOS025310819;C21-H17-Cl-N8-O7-S2

Chemical Property of Reactive Yellow 3

Chemical Property:

• Refractive Index: 1.794
• PKA: -0.71±0.40(Predicted)
• PSA: 256.04000
• Density: 1.81 g/cm³
• LogP: 6.76000
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 7
• Exact Mass: 592.0350150
• Heavy Atom Count: 39
• Complexity: 1120

Purity/Quality:

98%Min ^*data from raw suppliers

ReactiveYellow3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)N)Cl)N=NC3=CC4=C(C=CC=C4S(=O)(=O)O)C(=C3)S(=O)(=O)O
• Uses: Reactive Yellow 3 is a pigment used in the colourization of plastics. Reactive Yellow 3 degrades under UV light.