N,N-Diethyl-P-phenylenediamine

Base Information

• Chemical Name: N,N-Diethyl-P-phenylenediamine
• CAS No.: 93-05-0
• Molecular Formula: C10H16N2
• Molecular Weight: 164.25
• Hs Code.: 29215190
• European Community (EC) Number: 202-214-1
• NSC Number: 147488
• UN Number: 1673
• UNII: 0QQA4DFV2J
• DSSTox Substance ID: DTXSID2025058
• Nikkaji Number: J28.419J
• Wikipedia: Color_Developing_Agent_1
• Wikidata: Q3032706
• ChEMBL ID: CHEMBL1452158
• Mol file: 93-05-0.mol

Synonyms:4-amino-N,N-diethylaniline;4-amino-N,N-diethylaniline sulfate;N,N-diethyl 4-phenylenediamine;N,N-diethyl 4-phenylenediamine hydrochloride;N,N-diethyl 4-phenylenediamine monohydrochloride;N,N-diethyl 4-phenylenediamine oxalate (2:1);N,N-diethyl 4-phenylenediamine sulfate;N,N-diethyl 4-phenylenediamine sulfate (1:1);N,N-diethyl p-phenylenediamine;N,N-diethyl-1,4-phenylenediamine;N,N-diethyl-p-phenylenediamine

Chemical Property of N,N-Diethyl-P-phenylenediamine

Chemical Property:

• Appearance/Colour: yellow to brown solid or liquid
• Melting Point: 19-21 °C(lit.)
• Refractive Index: n20/D 1.571(lit.)
• Boiling Point: 261 °C at 760 mmHg
• PKA: 8.21±0.32(Predicted)
• Flash Point: 108.9 °C
• PSA: 29.26000
• Density: 1.009 g/cm³
• LogP: 2.69620
• Storage Temp.: Freezer
• Solubility.: water: insoluble
• Water Solubility.: <0.1 g/100 mL at 19 oC
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 164.131348519
• Heavy Atom Count: 12
• Complexity: 113
• Transport DOT Label: Poison

Purity/Quality:

99.9% ^*data from raw suppliers

N1,N1-diethyl-1,4-Benzenediamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25-34
• Safety Statements: 26-36-45

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aromatic
• Canonical SMILES: CCN(CC)C1=CC=C(C=C1)N
• Uses: Dye intermediate, source of diazonium compounds in diazo copying process. N,N-Diethyl-p-phenylenediamine has been employed as a reference probe to investigate rapid chlorination rate constants by a stopped-flow spectrophotometric competition kinetics method.

Technology Process of N,N-Diethyl-P-phenylenediamine

There total 36 articles about N,N-Diethyl-P-phenylenediamine 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%

2-[(4-diethylaminophenylamino)methylene]malonic acid diethyl ester (104007-17-2) → N,N-diethylaniline (93-05-0)

Guidance literature:

With ethylenediamine; In ethanol; at 20 ℃; for 0.25h;

DOI:10.1002/chem.200902054

Reference yield: 86.0%

N,N-diethyl-4-nitrosoaniline (120-22-9) → N,N-diethylaniline (93-05-0)

Guidance literature:

With ammonium chloride; aluminium; In methanol; for 5h; Heating;

Reference yield: 67.0%

N,N-diethyl-4-nitrosoaniline (120-22-9) → C20H30N4 + N,N-diethylaniline (93-05-0)

Guidance literature:

With potassium hydroxide; aluminium; In methanol; at 20 ℃; for 0.25h;

upstream raw materials:

N,N-diethyl-4-nitrosoaniline

4,4'-Bis-diaethylamino-azobenzol

C₁₉H₁₉N₃O₂

4-diethylamino-4'-nitroazobenzene

Downstream raw materials:

4-(4-diethylamino-phenylimino)-5-phenyl-2,4-dihydro-pyrazol-3-one

4-(4-diethylamino-phenylimino)-2,5-diphenyl-2,4-dihydro-pyrazol-3-one

4-[3-amino-4-(4-diethylamino-phenylimino)-5-oxo-4,5-dihydro-pyrazol-1-yl]-benzonitrile

Refernces

• 1、 Mirica, Liviu M.,Na, Hanah,Rath, Nigam P.,Tang, Fengzhi,Watson, Michael B.. "Photoreductive chlorine elimination from a Ni(iii)Cl2complex supported by a tetradentate pyridinophane ligand". supporting information. p. 7264 - 7267. Retrieved 2021/07/28.
• 2、 Gholinejad, Mohammad,Naghshbandi, Zhwan,Sansano, José M.. "Co/Cu bimetallic ZIF as New heterogeneous catalyst for reduction of nitroarenes and dyes". . . Retrieved 2020/02/04.