Biphenyl-4-carboxamidine hydrochloride

Base Information

• Chemical Name: Biphenyl-4-carboxamidine hydrochloride
• CAS No.: 111082-23-6
• Molecular Formula: C13H12 N2 . Cl H
• Molecular Weight: 232.713
• European Community (EC) Number: 850-288-4
• DSSTox Substance ID: DTXSID60560251
• Mol file: 111082-23-6.mol

Synonyms:111082-23-6;BIPHENYL-4-CARBOXAMIDINE HYDROCHLORIDE;[1,1'-Biphenyl]-4-carboximidamide hydrochloride;4-phenylbenzenecarboximidamide;hydrochloride;MFCD04114455;4-phenylbenzene-1-carboximidamide hydrochloride;SCHEMBL6029673;DTXSID60560251;4-Biphenylcarboximidamide Hydrochloride;AKOS008122127;AB18377;DS-7789;SY111073;CS-0156437;EN300-70562;[1,1'-BIPHENYL]-4-CARBOXIMIDAMIDE HCL;[1,1'-Biphenyl]-4-carboximidamidehydrochloride;BIPHENYL-4-CARBOXIMIDAMIDE HYDROCHLORIDE;C71372;A802291;Z1211228967;[1,1'-Biphenyl]-4-carboximidamide--hydrogen chloride (1/1)

Chemical Property of Biphenyl-4-carboxamidine hydrochloride

Chemical Property:

• PSA: 49.87000
• LogP: 4.23970
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 232.0767261
• Heavy Atom Count: 16
• Complexity: 211

Purity/Quality:

98% ^*data from raw suppliers

[1,1'-Biphenyl]-4-carboximidamidehydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=N)N.Cl
• Uses: 4-Phenylbenzamidine hydrochloride is an amine derivative, which can be used as a pharmaceutical intermediate for pharmaceutical synthesis and pharmaceutical experimental research.

Technology Process of Biphenyl-4-carboxamidine hydrochloride

There total 1 articles about Biphenyl-4-carboxamidine 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: 76.0%

ethyl biphenyl-4-carboximidate hydrochloride → 1,1-biphenyl-4-carboxamidine hydrochloride (111082-23-6)

Guidance literature:

With ammonia; In methanol; ethanol; at 20 ℃; for 12h;

Reference yield: 85.0%

m-bromobenzoic aldehyde (3132-99-8) + 1,1-biphenyl-4-carboxamidine hydrochloride (111082-23-6) → 2,4-di([1,1'-biphenyl]-4-yl)-6-(4-bromophenyl)-1,3,5-triazine (877456-11-6)

Guidance literature:

With copper diacetate; sodium carbonate; In toluene; at 110 ℃; for 30h; Reagent/catalyst;

Reference yield: 85.0%

1,2-Cyclohexanediol (931-17-9) + 1,1-biphenyl-4-carboxamidine hydrochloride (111082-23-6) → C19H18N2O

Guidance literature:

With pyridine; oxygen; potassium hydroxide; at 110 ℃; for 16h; chemoselective reaction; Green chemistry;

DOI:10.1016/j.jcat.2021.04.022

Downstream raw materials:

2-(4-(1,1'-biphenylyl))-6-nitro-cycloheptimidazole

3-chloro-3-(4-biphenyl)diazirine

C₃₆H₂₄N₂

C₃₂H₂₈N₂O₄

Refernces