3-(Piperidin-1-ylsulfonyl)aniline

Base Information

• Chemical Name: 3-(Piperidin-1-ylsulfonyl)aniline
• CAS No.: 22184-99-2
• Molecular Formula: C11H16N2O2S
• Molecular Weight: 240.326
• Hs Code.: 2935009090
• European Community (EC) Number: 696-354-4
• DSSTox Substance ID: DTXSID50383416
• Wikidata: Q82175113
• Mol file: 22184-99-2.mol

Synonyms:22184-99-2;3-(Piperidin-1-ylsulfonyl)aniline;1-[(3-Aminophenyl)sulfonyl]piperidine;3-(Piperidine-1-sulfonyl)-phenylamine;3-piperidin-1-ylsulfonylaniline;3-(piperidine-1-sulfonyl)aniline;3-(PIPERIDINOSULFONYL)ANILINE;3-(1-piperidylsulfonyl)aniline;[3-(Piperidin-1-ylsulfonyl)phenyl]amine;3-[(PIPERIDIN-1-YL)SULPHONYL]ANILINE;SCHEMBL264656;SCHEMBL1412217;DTXSID50383416;AHQOQYXOKZRRPJ-UHFFFAOYSA-N;MFCD02063328;3-(Piperidine-1-sulfonyl)phenylamine;AKOS000115603;AB10634;CCG-311464;PS-3707;SDCCGMLS-0066182.P001;3-(piperidinosulfonyl)aniline, AldrichCPR;BAS 09105951;CS-0368631;EN300-02113;SR-01000323142;SR-01000323142-1;Z56792382

Chemical Property of 3-(Piperidin-1-ylsulfonyl)aniline

Chemical Property:

• Vapor Pressure: 1.1E-07mmHg at 25°C
• Melting Point: 117 °C
• Refractive Index: 1.602
• Boiling Point: 432.6 °C at 760 mmHg
• Flash Point: 215.4 °C
• PSA: 71.78000
• Density: 1.284g/cm³
• LogP: 3.04330
• Storage Temp.: 2-8°C
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 240.09324893
• Heavy Atom Count: 16
• Complexity: 317

Purity/Quality:

98%min ^*data from raw suppliers

3-[(Piperidin-1-yl)sulfonyl]aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-36
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N

Technology Process of 3-(Piperidin-1-ylsulfonyl)aniline

There total 4 articles about 3-(Piperidin-1-ylsulfonyl)aniline 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: 100.0%

1-((3-nitrophenyl)sulfonyl)piperidine (91619-31-7) → 3-(piperidine-1-sulfonyl)-phenylamine (22184-99-2)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In ethanol;

Reference yield:

piperidine (110-89-4) → 3-(piperidine-1-sulfonyl)-phenylamine (22184-99-2)

Guidance literature:

Multi-step reaction with 2 steps

1: dichloromethane / 0 - 20 °C

2: palladium 10% on activated carbon; hydrogen / ethanol

With palladium 10% on activated carbon; hydrogen; In ethanol; dichloromethane;

Reference yield:

3-nitrobenzenesulphonyl chloride (121-51-7) → 3-(piperidine-1-sulfonyl)-phenylamine (22184-99-2)

Guidance literature:

Multi-step reaction with 2 steps

1: dichloromethane / 0 - 20 °C

2: palladium 10% on activated carbon; hydrogen / ethanol

With palladium 10% on activated carbon; hydrogen; In ethanol; dichloromethane;

upstream raw materials:

1-((3-nitrophenyl)sulfonyl)piperidine

piperidine

3-nitrobenzenesulphonyl chloride

Downstream raw materials:

1-(3-benzylaminophenylsulfonyl)piperidine

2-chloro-N-[3-(piperidinyl-1-sulfonyl)phenyl]acetamide

1-[3-(piperidine-1-sulfonyl)phenyl]-3-(pyridin-3-ylmethyl)urea

5-methyl-N₂-[3-(piperidine-1-sulfonyl)-phenyl]-pyrimidine-2,4-diamine

Refernces

• 1、 Qandil, Amjad M.,Hassan, Mohammad A.,Al-Shar'i, Nizar A.. "Synthesis and anticandidal activity of azole-containing sulfonamides". experimental part. p. 99 - 112. Retrieved 2009/04/03.