[(e)-(4-Methoxyphenyl)diazenyl]propanedinitrile

Base Information

• Chemical Name: [(e)-(4-Methoxyphenyl)diazenyl]propanedinitrile
• CAS No.: 5436-32-8
• Molecular Formula: C10H8 N4 O
• Molecular Weight: 200.1967
• NSC Number: 21677
• DSSTox Substance ID: DTXSID20281435
• Mol file: 5436-32-8.mol

Synonyms:5436-32-8;[(e)-(4-methoxyphenyl)diazenyl]propanedinitrile;NSC21677;BDBM4381;DTXSID20281435;NSC-21677;[(p-Methoxyphenyl)hydrazono]malononitrile;benzylidenemalononitrile (BMN) deriv. 67;cyano-N-(4-methoxyphenyl)methanecarbohydrazonoyl cyanide

Chemical Property of [(e)-(4-Methoxyphenyl)diazenyl]propanedinitrile

Chemical Property:

• Vapor Pressure: 0.000474mmHg at 25°C
• Boiling Point: 314.2°Cat760mmHg
• Flash Point: 143.8°C
• Density: 1.15g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 200.06981089
• Heavy Atom Count: 15
• Complexity: 297

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)N=NC(C#N)C#N

Technology Process of [(e)-(4-Methoxyphenyl)diazenyl]propanedinitrile

There total 1 articles about [(e)-(4-Methoxyphenyl)diazenyl]propanedinitrile 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: 82.0%

4-methoxy-aniline (104-94-9) + malononitrile (109-77-3) → 2-(4-Methoxy-phenylazo)-malononitrile (5436-32-8)

Guidance literature:

4-methoxy-aniline; With hydrogenchloride; sodium nitrite; In water; at 0 - 5 ℃;

malononitrile; With sodium acetate; In ethanol; water; at 0 - 5 ℃; for 1.5h; pH=3 - 4;

DOI:10.1007/s10593-010-0494-1

Reference yield: 92.0%

5-hyrazino-3,4-diphenyl-7H-pyrazolo-<3,4-c>-pyridazine (128462-44-2) + 2-(4-Methoxy-phenylazo)-malononitrile (5436-32-8) → C27H22N10O (1239368-81-0)

Guidance literature:

With hydrogenchloride; In ethanol; water; for 10h; Reflux;

DOI:10.1007/s10593-010-0494-1

Reference yield: 90.0%

2-(9H-fluoren-9-ylidene)-2-mercaptoacetic acid (1316194-27-0) + 2-(4-Methoxy-phenylazo)-malononitrile (5436-32-8) → C24H13ClN4OS (1316194-36-1)

Guidance literature:

With acetic acid; for 0.0333333h; Microwave irradiation;

DOI:10.3987/COM-11-12141

upstream raw materials:

4-methoxy-aniline

malononitrile

Downstream raw materials:

4-((4-methoxyphenyl)diazenyl)-1H-pyrazole-3,5-diamine

3-[3,5-Diamino-4-(4-methoxy-phenylazo)-pyrazol-1-yl]-propionitrile

4-(4-Methoxy-phenylazo)-isoxazole-3,5-diamine

3-(4-Methoxy-phenylazo)-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-ylamine