4,6-Di(piperidin-1-yl)benzene-1,3-diamine

Base Information

• Chemical Name: 4,6-Di(piperidin-1-yl)benzene-1,3-diamine
• CAS No.: 5180-30-3
• Molecular Formula: C16H26N4
• Molecular Weight: 274.4044
• DSSTox Substance ID: DTXSID00356731
• Wikidata: Q82136274
• Mol file: 5180-30-3.mol

Synonyms:4,6-di(piperidin-1-yl)benzene-1,3-diamine;5180-30-3;CBMicro_047834;Oprea1_049632;Oprea1_191980;DTXSID00356731;AKOS000601355;BIM-0047955.P001

Chemical Property of 4,6-Di(piperidin-1-yl)benzene-1,3-diamine

Chemical Property:

• Vapor Pressure: 3.38E-11mmHg at 25°C
• Boiling Point: 527°Cat760mmHg
• Flash Point: 327°C
• Density: 1.15g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 274.21574685
• Heavy Atom Count: 20
• Complexity: 269

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=CC(=C(C=C2N)N)N3CCCCC3

Technology Process of 4,6-Di(piperidin-1-yl)benzene-1,3-diamine

There total 1 articles about 4,6-Di(piperidin-1-yl)benzene-1,3-diamine 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:

isothiocyanatocyclohexane (1122-82-3) → N-Cyclohexyl-S-chlor-isothiocarbamoylchlorid (5180-30-3)

Guidance literature:

With chlorine; In pentane;

DOI:10.1021/jo01341a046

Reference yield:

N-Cyclohexyl-S-chlor-isothiocarbamoylchlorid (5180-30-3) + methyl isocyanate (624-83-9) → 4-cyclohexyl-2-methyl-[1,2,4]thiadiazolidine-3,5-dione

Guidance literature:

With air; In hexane; at 20 ℃; for 10h;

DOI:10.1021/jm011020u

Reference yield:

N-Cyclohexyl-S-chlor-isothiocarbamoylchlorid (5180-30-3) → 2,4-Dicyclohexyl-[1,2,4]thiadiazolidine-3,5-dithione (135472-20-7)

Guidance literature:

Multi-step reaction with 2 steps

1: 8 percent / benzene / Ambient temperature

2: 60 percent / NEt₃ / ethanol / Heating

With triethylamine; In ethanol; benzene;

upstream raw materials:

isothiocyanatocyclohexane

Downstream raw materials:

(chloro-cyclohexylimino-methylsulfanyl)-isopropyl-carbamoyl chloride

4-phenyl-5-phenylimino-3-thio-1,2,4-thiadiazolidine

5-[(Z)-Cyclohexylimino]-4-phenyl-[1,2,4]dithiazolidine-3-thione

2,4-Dicyclohexyl-[1,2,4]thiadiazolidine-3,5-dithione