3,4-Dichlorophenylbiguanide

Base Information

• Chemical Name: 3,4-Dichlorophenylbiguanide
• CAS No.: 15233-34-8
• Molecular Formula: C₈H₉Cl₂N₅
• Molecular Weight: 246.099
• DSSTox Substance ID: DTXSID80165000
• Nikkaji Number: J618.013B
• ChEMBL ID: CHEMBL41433
• Mol file: 15233-34-8.mol

Synonyms:3,4-dichlorophenylbiguanide

Chemical Property of 3,4-Dichlorophenylbiguanide

Chemical Property:

• Vapor Pressure: 4.89E-09mmHg at 25°C
• Boiling Point: 470.9°C at 760 mmHg
• Flash Point: 238.6°C
• PSA: 97.78000
• Density: 1.62g/cm³
• LogP: 3.18680
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 245.0235007
• Heavy Atom Count: 15
• Complexity: 274

Purity/Quality:

99% ^*data from raw suppliers

1-(3,4-DICHLOROPHENYL)BIGUANIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1N=C(N)N=C(N)N)Cl)Cl

Technology Process of 3,4-Dichlorophenylbiguanide

There total 2 articles about 3,4-Dichlorophenylbiguanide 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:

3,4-dichloroaniline hydrochloride (33240-95-8) + N-Cyanoguanidine (127099-85-8,780722-26-1,461-58-5) → 3,4-Dichlorophenylbiguanide (15233-34-8)

Guidance literature:

With propan-1-ol;

DOI:10.1021/jo01107a002

Reference yield:

→ 3,4-Dichlorophenylbiguanide (15233-34-8)

Guidance literature:

3,4-Dichloranilin, Dicyandiamid, HCl;

Reference yield:

3,4-Dichlorophenylbiguanide (15233-34-8) + acetaldehyde (75-07-0,9002-91-9) → 1-(3,4-dichloro-phenyl)-6-methyl-1,6-dihydro-[1,3,5]triazine-2,4-diyldiamine; hydrochloride (114327-67-2)

Guidance literature:

With hydrogenchloride; ethanol; water;

DOI:10.1021/jo01107a002

upstream raw materials:

3,4-dichloroaniline hydrochloride

N-Cyanoguanidine

Downstream raw materials:

1-(3,4-dichloro-phenyl)-6-methyl-1,6-dihydro-[1,3,5]triazine-2,4-diyldiamine; hydrochloride

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