(2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride

Base Information

• Chemical Name: (2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride
• CAS No.: 437651-47-3
• Molecular Formula: C30H41ClN2O5
• Molecular Weight: 545.119
• DSSTox Substance ID: DTXSID80436747
• Mol file: 437651-47-3.mol

Synonyms:437651-47-3;(2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride;(2-butyl-5-nitro-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone;hydrochloride;(2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)-propoxy)phenyl)methanone hydrochloride;(2-butyl-5-nitro-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Hydrochloride;SCHEMBL5711138;DTXSID80436747;VJTDMGXBKGWRNM-UHFFFAOYSA-N;AKOS015896314;AC-24021;A826418;(2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanonehydrochloride;2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl)-5-nitrobenzofuran hydrochloride;(2-Butyl-5-nitro-1-benzofuran-3-yl){4-[3-(dibutylamino)propoxy]phenyl}methanone--hydrogen chloride (1/1);(2-butyl-5-nitro-3-benzo[b]furanyl)[4-[3-(dibutylamino)propoxy]phenyl]methanone hydrochloride

Chemical Property of (2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride

Chemical Property:

• Vapor Pressure: 3.49E-16mmHg at 25°C
• Boiling Point: 638.1 °C at 760 mmHg
• Flash Point: 339.7 °C
• PSA: 88.50000
• LogP: 8.91090
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 16
• Exact Mass: 544.2704001
• Heavy Atom Count: 38
• Complexity: 667

Purity/Quality:

(2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)-propoxy)phenyl)methanone hydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC.Cl

Technology Process of (2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride

There total 1 articles about (2-Butyl-5-nitrobenzofuran-3-yl)(4-(3-(dibutylamino)propoxy)phenyl)methanone hydrochloride 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%

4-[3-(di-n-butylamino)-propoxy]-benzoic acid chloride hydrochloride + 2-(n-butyl)-5-nitrobenzofuran (133238-87-6) → 2-butyl-3-(4-[3(dibutylamino)propoxy]benzoyl)-5-nitro-benzofuran hydrochloride (437651-47-3)

Guidance literature:

4-[3-(di-n-butylamino)-propoxy]-benzoic acid chloride hydrochloride; 2-(n-butyl)-5-nitrobenzofuran; In water; at 0 - 22 ℃; for 1.5h;

With iron(III) chloride; at 20 - 22 ℃; for 1.5h;

upstream raw materials:

2-(n-butyl)-5-nitrobenzofuran

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