Clanobutin

Base Information

• Chemical Name: Clanobutin
• CAS No.: 30544-61-7
• Molecular Formula: C18H18 Cl N O4
• Molecular Weight: 347.798
• Hs Code.: 2924299090
• European Community (EC) Number: 250-232-3
• UNII: W6Y945055S
• DSSTox Substance ID: DTXSID10184628
• Nikkaji Number: J20.282G
• Wikidata: Q27292414
• NCI Thesaurus Code: C77837
• ChEMBL ID: CHEMBL2107589
• Mol file: 30544-61-7.mol

Synonyms:4-(4-chloro-N-(4-methoxyphenyl)benzamido)butyric acid;Bykahepar;clanobutin;clanobutin, sodium salt

Chemical Property of Clanobutin

Chemical Property:

• Vapor Pressure: 1.73E-13mmHg at 25°C
• Melting Point: 115-116°
• Refractive Index: 1.6800 (estimate)
• Boiling Point: 562.4°Cat760mmHg
• PKA: 5.04(at 25℃)
• Flash Point: 294°C
• PSA: 66.84000
• Density: 1.302g/cm³
• LogP: 3.86020
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• Water Solubility.: 44.17mg/L(37 oC)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 347.0924357
• Heavy Atom Count: 24
• Complexity: 415

Purity/Quality:

99% ^*data from raw suppliers

Clanobutin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)N(CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl
• Uses: Clanobutin inhibits gluconeogenesis in isolated perfused rat livers. it is a a choleretic and digestion-stimulating agent for animals.

Technology Process of Clanobutin

There total 3 articles about Clanobutin 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:

dichloromethylphenylsilane (149-74-6) → diazidomethylphenylsilane (30540-34-2)

Guidance literature:

With sodium azide; In N,N-dimethyl-formamide;

DOI:10.1016/S0022-328X(00)88402-8

Reference yield:

→ diazidomethylphenylsilane (30540-34-2)

Guidance literature:

Methylphenyldichlorsilan, NaN3;

Reference yield:

→ 4-<4-chloro-N-(4-methoxyphenyl)-benzamido>-butyric acid (30544-61-7)

Guidance literature:

γ-(p-Anisidino)-buttersaeurehydrochlorid, Benzoylchlorid;

upstream raw materials:

dichloromethylphenylsilane

Downstream raw materials:

N-[N-(p-chlorobenzoyl)-4-(p-anisidino)butyryl]glycine

ethyl N-[N-(p-chlorobenzoyl)-4-(p-anisidino)butyryl]glycinate

methyl N-[N-(p-chlorobenzoyl)-4-(p-anisidino)butyryl]-4-(p-anisidino)butyrate

N-[N-(p-chlorobenzoyl)-4-(p-anisidino)butyryl]-4-(p-anisidino)butyric acid

Refernces

• 1、 Klemm,Krastinat,Krueger. "Synthesis and physico-chemical parameters of clanobutin". . p. 1 - 2. Retrieved 2007/10/16.
• 2、 S. Washburne, Stephen,R. Peterson Jr., William. "Facile preparation of silyl azides with dipolar aprotic solvents". . p. 153 - 156. Retrieved 2007/10/05.