1-Chloro-4-(4-chlorophenylamino)-phthalazine

Base Information

• Chemical Name: 1-Chloro-4-(4-chlorophenylamino)-phthalazine
• CAS No.: 284031-04-5
• Molecular Formula: C14H9Cl2N3
• Molecular Weight: 290.152
• DSSTox Substance ID: DTXSID40477070
• Wikidata: Q82309178
• Mol file: 284031-04-5.mol

Synonyms:284031-04-5;1-chloro-4-(4-chlorophenylamino)-phthalazine;4-chloro-N-(4-chlorophenyl)phthalazin-1-amine;SCHEMBL6496240;DTXSID40477070;RAUVPXRMDTXJPQ-UHFFFAOYSA-N;AKOS006035795;1-chloro-4-(4-chlorophenylamino)phthalazine

Chemical Property of 1-Chloro-4-(4-chlorophenylamino)-phthalazine

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 289.0173527
• Heavy Atom Count: 19
• Complexity: 294

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=NN=C2Cl)NC3=CC=C(C=C3)Cl

Technology Process of 1-Chloro-4-(4-chlorophenylamino)-phthalazine

There total 3 articles about 1-Chloro-4-(4-chlorophenylamino)-phthalazine 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: 98.0%

1,4-dichlorophthalazine (4752-10-7) + 4-chloro-aniline (106-47-8) → (4-chlorophenyl)-(4-chlorophthalazin-1-yl)amine (284031-04-5)

Guidance literature:

In isopropyl alcohol; at 100 ℃; for 1h;

DOI:10.1016/j.ejmech.2019.05.026

Reference yield:

2,3-dihydrophthalazine-1,4-dione (1445-69-8) → (4-chlorophenyl)-(4-chlorophthalazin-1-yl)amine (284031-04-5)

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine; trichlorophosphate / 1 h / Reflux

2: isopropyl alcohol / 1 h / 100 °C

With pyridine; trichlorophosphate; In isopropyl alcohol;

DOI:10.1016/j.ejmech.2019.05.026

Reference yield:

→ (4-chlorophenyl)-(4-chlorophthalazin-1-yl)amine (284031-04-5)

Guidance literature:

/BRN= 207626/;

DOI:10.1039/jr9480000777

upstream raw materials:

1,4-dichlorophthalazine

4-chloro-aniline

2,3-dihydrophthalazine-1,4-dione

Downstream raw materials:

HUBS-23

1-(4-chlorophenylamino)-4-(pyridin-3-ylmethoxy)phthalazine

2-{3-[4-(3-acetamidophenyl)piperidin-1-yl]propyl}-4-[(chlorophenyl)amino]phthalazin-1(2H)-one

C₁₄H₁₀ClN₃O