2,4,6-Triisopropylbenzenesulfonamide

Base Information

• Chemical Name: 2,4,6-Triisopropylbenzenesulfonamide
• CAS No.: 105536-22-9
• Molecular Formula: C15H25 N O2 S
• Molecular Weight: 283.435
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID80352973
• Nikkaji Number: J1.025.392F
• Wikidata: Q72513618
• ChEMBL ID: CHEMBL3400904
• Mol file: 105536-22-9.mol

Synonyms:2,4,6-Triisopropylbenzenesulfonamide;105536-22-9;2,4,6-tri(propan-2-yl)benzenesulfonamide;CHEMBL3400904;2,4,6-tris(propan-2-yl)benzene-1-sulfonamide;CBMicro_034663;Oprea1_497094;SCHEMBL1069046;DTXSID80352973;PRMNQLMPSVOZIX-UHFFFAOYSA-N;2,4,6-Triisopropylbenzenesulfonamine;BDBM50063853;MFCD00051975;2,4,6-Tri-isopropylbenzenesulfonamide;AKOS024318932;SB82398;AS-62953;BIM-0034751.P001;CS-0273806;FT-0609882;?2,4,6-TRIISOPROPYLBENZENESULFONAMIDE;A801259;EN300-18537102

Chemical Property of 2,4,6-Triisopropylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 5.56E-06mmHg at 25°C
• Melting Point: 113-116°C
• Refractive Index: 1.513
• Boiling Point: 380.2°Cat760mmHg
• PKA: 10.33±0.60(Predicted)
• Flash Point: 183.7°C
• PSA: 68.54000
• Density: 1.055g/cm³
• LogP: 5.48530
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 283.16060021
• Heavy Atom Count: 19
• Complexity: 363

Purity/Quality:

97% ^*data from raw suppliers

2,4,6-Triisopropylbenzenesulfonamide 95+% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N)C(C)C

Technology Process of 2,4,6-Triisopropylbenzenesulfonamide

There total 12 articles about 2,4,6-Triisopropylbenzenesulfonamide 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%

2,4,6-triisopropylphenylsulfonyl chloride (6553-96-4) → 2,4,6-triisopropylbenzene sulfonamide (105536-22-9)

Guidance literature:

With ammonium hydroxide; In tetrahydrofuran; at 20 ℃; for 0.5h;

DOI:10.1016/j.ejmech.2014.11.020

Reference yield: 96.0%

2,4,6-Triisopropylbenzenesulfonyl azide (36982-84-0) → 2,4,6-triisopropylbenzene sulfonamide (105536-22-9)

Guidance literature:

With hydrogen; In ethanol; at 20 ℃; for 2h; under 760.051 Torr;

DOI:10.1016/j.tetlet.2019.02.035

Reference yield: 96.0%

N-(tert-butyl)-2,4,6-triisopropylbenzenesulfonamide (67475-08-5) → 2,4,6-triisopropylbenzene sulfonamide (105536-22-9)

Guidance literature:

With scandium tris(trifluoromethanesulfonate); In nitromethane; at 50 ℃; for 5h;

DOI:10.1081/SCC-200048949

upstream raw materials:

(3(2S),4S)-3-<2-<3-<<2,4,6-tris(1-methylethyl)phenyl>sulfonyl>triazino>-3-methyl-1-oxobutyl>-4-(phenylmethyl)-2-oxazolidinone

N-(tert-butyl)-2,4,6-triisopropylbenzenesulfonamide

2,4,6-triisopropylphenylsulfonyl chloride

1-(2,4,6-triisopropylphenylsulfonyl)aziridine

Downstream raw materials:

C₁₈H₂₇N₃O₂S₂

(E,E,E)-1,6,11-tris[(2,4,6-triisopropylphenyl)sulfonyl]-1,6,11-triazacyclopentadeca-3,8,13-triene

(E,E,E,E)-1,6,11,16-tetrakis[(2,4,6-triisopropylphenyl)sulfonyl]-1,6,11,16-tetraazacycloicosa-3,8,13,18-tetraene