3-OXOHEXANENITRILE

Base Information

• Chemical Name: 3-OXOHEXANENITRILE
• CAS No.: 4388-92-5
• Molecular Formula: C6H9 N O
• Molecular Weight: 111.144
• Hs Code.: 2926909090
• Mol file: 4388-92-5.mol

Synonyms:1-Cyanopentan-2-one;3-Ketocapronitrile; 3-Oxohexanenitrile; Butanoylacetonitrile;Butyrylacetonitrile

Chemical Property of 3-OXOHEXANENITRILE

Chemical Property:

• Vapor Pressure: 1.644mmHg at 25°C
• Refractive Index: 1.419
• Boiling Point: 168.1°Cat760mmHg
• PKA: 10.31±0.10(Predicted)
• Flash Point: 55.5°C
• PSA: 40.86000
• Density: 0.941g/cm³
• LogP: 1.26928

Purity/Quality:

97% ^*data from raw suppliers

3-oxohexanenitrile ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

Technology Process of 3-OXOHEXANENITRILE

There total 6 articles about 3-OXOHEXANENITRILE 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: 92.0%

cyanoacetic acid (372-09-8) + butyryl chloride (141-75-3) → 3-oxohexanenitrile (4388-92-5)

Guidance literature:

cyanoacetic acid; With [2,2]bipyridinyl; n-butyllithium; In tetrahydrofuran; hexane; at -78 - -10 ℃;

butyryl chloride; In tetrahydrofuran; hexane; for 0.5h;

DOI:10.1055/s-2002-34845

Reference yield: 82.0%

butanoic acid methyl ester (623-42-7) + acetonitrile (75-05-8,26809-02-9) → 3-oxohexanenitrile (4388-92-5)

Guidance literature:

With sodium hydride; In tetrahydrofuran; at 70 ℃; for 8h;

Reference yield: 61.0%

→ 3-oxohexanenitrile (4388-92-5)

Guidance literature:

With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h;

In tetrahydrofuran; hexane; at -78 ℃; for 1h;

upstream raw materials:

butanoic acid ethyl ester

acetonitrile

2-cyano-3-oxo-hexanoic acid ethyl ester

1-chloropentane-2-one

Downstream raw materials:

ethyl butyroyl acetate

5-Propyl-1-(2,4,6-trichloro-phenyl)-1H-pyrazole-4-carbonitrile

1-<5-amino-1-(2,4,6-trichlorophenyl)pyrazol-4-yl>butan-1-one

5-{[(tert-butoxycarbonyl)amino]methyl}-2-methyl-4-(4-methylphenyl)-6-propylnicotinic acid

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 4388-92-5 3-OXOHEXANENITRILE

Send

Send

Metric Ton KG G Pound L ML

Send

Send