2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide

Base Information

• Chemical Name: 2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide
• CAS No.: 5102-83-0
• Deprecated CAS: 108563-17-3,12642-91-0,196522-51-7,61614-29-7,1264-07-9
• Molecular Formula: C₃₆H₃₄Cl₂N₆O₄
• Molecular Weight: 685.61
• DSSTox Substance ID: DTXSID0029268
• Mol file: 5102-83-0.mol

Synonyms:2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide;DTXSID0029268;NS00006890

Chemical Property of 2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide

Chemical Property:

• Appearance/Colour: Odorless fine yellow powder.
• Melting Point: 312-320 °C
• Refractive Index: 1.631
• Boiling Point: 799.5 °C at 760 mmHg
• PKA: 0.72±0.59(Predicted)
• Flash Point: 437.3 °C
• PSA: 141.78000
• Density: 1.29 g/cm³
• LogP: 9.40000
• Water Solubility.: <0.1 g/100 mL at 22 oC
• XLogP3: 10.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 684.2018590
• Heavy Atom Count: 48
• Complexity: 1140

Purity/Quality:

98% ^*data from raw suppliers

PigmentYellow13 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)NC(=O)C(=NNC2=C(C=C(C=C2)C3=CC(=C(C=C3)NN=C(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C(=O)C)C
• Uses: Pigment yellow 13 (CAS# 5102-83-0) is a pigment used as a color stabilizer of wood flour/polypropylene composites.

Technology Process of 2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide

There total 1 articles about 2-[[2-chloro-4-[3-chloro-4-[2-[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-ylidene]hydrazinyl]phenyl]phenyl]hydrazinylidene]-N-(2,4-dimethylphenyl)-3-oxobutanamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.0%

3,3'-dichlorobenzidine (91-94-1) + m-acetoacetoxylidide (97-36-9) → pigment yellow 13 (5102-83-0,61614-29-7)

Guidance literature:

With hydrogenchloride; sodium nitrite; In water; at 20 ℃; for 0.333333h; Green chemistry;

DOI:10.1039/c8gc03982h

upstream raw materials:

3,3'-dichlorobenzidine

m-acetoacetoxylidide

Refernces