4-Biphenylsulfonyl Chloride

Base Information

• Chemical Name: 4-Biphenylsulfonyl Chloride
• CAS No.: 1623-93-4
• Molecular Formula: C12HC9ClOC2S
• Molecular Weight: 252.721
• Hs Code.: 29049090
• European Community (EC) Number: 216-609-1
• UNII: A89GAW486V
• DSSTox Substance ID: DTXSID30167352
• Nikkaji Number: J195.251J
• Wikidata: Q83036705
• Mol file: 1623-93-4.mol

Synonyms:1623-93-4;4-Biphenylsulfonyl Chloride;Biphenyl-4-sulfonyl chloride;[1,1'-Biphenyl]-4-sulfonyl chloride;4-Phenylbenzenesulfonyl chloride;(1,1'-Biphenyl)-4-sulphonyl chloride;4-(Chlorosulfonyl)biphenyl;Biphenyl-4-sulphonyl chloride;biphenyl-4-sulfonylchloride;C12H9ClO2S;EINECS 216-609-1;(1,1'-Biphenyl)-4-sulfonyl chloride;[1,1'-biphenyl]-4-sulphonyl chloride;[1,1'-biphenyl]-4-sulfonylchloride;4-phenylbenzene-1-sulfonyl chloride;4-biphenylsulphonylchloride;p-Biphenylsulfonyl chloride;4-biphenyisulfonyl chloride;4-biphenylsulphonyl chloride;4-biphenyl sulfonyl chloride;biphenyl 4-sulfonyl chloride;4-biphenylylsulfonyl chloride;SCHEMBL48861;A89GAW486V;p-Phenylbenzenesulfonyl chloride;(4-Biphenylyl)sulfonyl chloride;DTXSID30167352;1,1'-biphenyl-4sulfonyl chloride;phenyl-benzene-4-sulfonyl chloride;1,1'-biphenyl-4-sulfonyl chloride;4-Phenylbenzenesulfonic acid chloride;AR2078;MFCD00078658;s5438;[1,1'-biphenyl]-4-sulfonyl chlonde;[1,1'-biphenyl]-4sulfonyl chloride;[1,1'-biphenyl]4-sulfonyl chloride;1,1'-biphenyl-4-ylsulfonyl chloride;AKOS000137051;1,1 '-biphenyl-4-ylsulfonyl chloride;CCG-266985;CS-W004121;DS-3892;[1,1''-Biphenyl]-4-sulfonyl chloride;NCGC00650297-01;([1,1'-Biphenyl]-4-yl)sulfonyl chloride;B2199;FT-0617687;EN300-44845;J-009933;F9995-1603

Chemical Property of 4-Biphenylsulfonyl Chloride

Chemical Property:

• Appearance/Colour: White crystalline powder
• Vapor Pressure: 1.7E-05mmHg at 25°C
• Melting Point: 103-108 °C(lit.)
• Refractive Index: 1.595
• Boiling Point: 375.3 °C at 760 mmHg
• Flash Point: 180.8 °C
• PSA: 42.52000
• Density: 1.32 g/cm³
• LogP: 4.36190
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Sensitive.: Moisture Sensitive
• Water Solubility.: Reacts with water.
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 252.0011784
• Heavy Atom Count: 16
• Complexity: 306

Purity/Quality:

99% ^*data from raw suppliers

Biphenyl-4-sulfonyl chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 14-34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)Cl
• Uses: Reactant for:? ;Preparation of anilinopyrimidinesulfonamides as potential anticancer agents1? ;Synthesis of inhibitors of the hypoxia inducible factor pathway2? ;Preparation of hydroxy-sulfonyl-piperidinyl butyramides as HDAC inhibitors and potential antitumors3? ;Palladium-catalyzed desulfitative C-arylation4 It is a reactant for preparation of anilinopyrimidinesulfonamides as potential anticancer agents, synthesis of inhibitors of the hypoxia inducible factor pathway. It participates in the preparation of hydroxy-sulfonyl-piperidinyl butyramides as HDAC inhibitors and potential antitumors and is also involved in palladium-catalyzed desulfitative C-arylation.

Technology Process of 4-Biphenylsulfonyl Chloride

There total 10 articles about 4-Biphenylsulfonyl Chloride 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: 81.0%

→ 4-diphenylsulfonyl chloride (1623-93-4)

Guidance literature:

Reference yield: 80.0%

4-biphenylmonosulfonic acid (2113-68-0) → 4-diphenylsulfonyl chloride (1623-93-4)

Guidance literature:

With thionyl chloride; N,N-dimethyl-formamide; at 80 ℃; for 2h;

DOI:10.1002/ardp.201600251

Reference yield: 80.0%

4-phenylalanine (92-67-1) → 4-diphenylsulfonyl chloride (1623-93-4)

Guidance literature:

4-phenylalanine; With hydrogenchloride; acetic acid; sodium nitrite; In water; acetonitrile; at 0 - 5 ℃;

With sulfur dioxide; copper dichloride; In water; acetonitrile; at 20 ℃; for 16h;

DOI:10.1016/S0040-4020(03)00018-8

upstream raw materials:

biphenyl

4-biphenylmonosulfonic acid

4-phenylalanine

4-bromo-1,1'-biphenyl

Downstream raw materials:

phenyl [1,1'-biphenyl]-4-sulfonate

4-biphenylthiol

N-(4-biphenylsulfonyl)-N-(4-bromo-3-methyl-5-isoxazolyl)-4-biphenylsulfonamide

(3R)-N-(4-biphenylylsulfonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

Refernces

• 1、 Adhikari, Nilanjan,Halder, Amit K.,Mallick, Sumana,Saha, Achintya,Saha, Kishna D.,Jha, Tarun. "Robust design of some selective matrix metalloproteinase-2 inhibitors over matrix metalloproteinase-9 through in silico/fragment-based lead identification and de novo lead modification: Syntheses and biological assays". . p. 4291 - 4309. Retrieved 2016.
• 2、 Humljan, Jan,Kotnik, Miha,Contreras-Martel, Carlos,Blanot, Didier,Urleb, Uro?,Dessen, Andréa,?olmajer, Tom,Gobec, Stanislav. "Novel naphthalene-N-sulfonyl-D-glutamic acid derivatives as inhibitors of MurD, a key peptidoglycan biosynthesis enzyme". scheme or table. p. 7486 - 7494. Retrieved 2009/11/30.