1-(2,6-Xylyl)biguanide

Base Information

• Chemical Name: 1-(2,6-Xylyl)biguanide
• CAS No.: 29213-16-9
• Molecular Formula: C10H15 N5
• Molecular Weight: 205.263
• European Community (EC) Number: 249-514-9
• DSSTox Substance ID: DTXSID90951810
• Nikkaji Number: J155.950H
• Mol file: 29213-16-9.mol

Synonyms:29213-16-9;1-(2,6-Xylyl)biguanide;N-(diaminomethylene)-N'-(2,6-dimethylphenyl)guanidine;1-(diaminomethylidene)-2-(2,6-dimethylphenyl)guanidine;EINECS 249-514-9;1-[(DIAMINOMETHYLIDENE)AMINO]-N-(2,6-DIMETHYLPHENYL)METHANIMIDAMIDE;Maybridge1_005872;n-(2,6-dimethylphenyl)imidodicarbonimidic diamide;SCHEMBL1740895;HMS558C20;CCG-657;DTXSID90951810;MFCD24539486;AKOS015998421;LS-08729;CS-0336015;N-(2,6-Dimethylphenyl)triimidodicarbonic diamide;Imidodicarbonimidic diamide, N-(2,6-dimethylphenyl)-

Chemical Property of 1-(2,6-Xylyl)biguanide

Chemical Property:

• Vapor Pressure: 1.13E-07mmHg at 25°C
• Boiling Point: 432.2°Cat760mmHg
• PKA: 11.57±0.10(Predicted)
• Flash Point: 215.2°C
• PSA: 97.78000
• Density: 1.25g/cm³
• LogP: 2.49680
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 205.13274550
• Heavy Atom Count: 15
• Complexity: 257

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)N=C(N)N=C(N)N

Technology Process of 1-(2,6-Xylyl)biguanide

There total 2 articles about 1-(2,6-Xylyl)biguanide 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:

N-Cyanoguanidine (127099-85-8,780722-26-1,461-58-5) + 2,6-dimethylaniline (87-62-7) → 1-(2,6-dimethyl-phenyl)-biguanide (29213-16-9)

Guidance literature:

With hydrogenchloride;

DOI:10.1021/ja01523a059

Reference yield:

→ 1-(2,6-dimethyl-phenyl)-biguanide (29213-16-9)

Guidance literature:

2,6-Dimethyl-anilin-hydrochlorid, Cyanguanidin;

DOI:10.1021/jm00340a008

Reference yield:

1-(2,6-dimethyl-phenyl)-biguanide (29213-16-9) → 1-(2,6-dimethyl-4-bromophenyl)biguanide

Guidance literature:

(bromination);

upstream raw materials:

N-Cyanoguanidine

2,6-dimethylaniline

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