5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile

Base Information

• Chemical Name: 5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile
• CAS No.: 89809-89-2
• Molecular Formula: C15H14 N2 O2
• Molecular Weight: 254.288
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID90377798
• Nikkaji Number: J1.950.294E
• Mol file: 89809-89-2.mol

Synonyms:5-acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile;5-acetyl-AMPCN

Chemical Property of 5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile

Chemical Property:

• Vapor Pressure: 2.95E-10mmHg at 25°C
• Melting Point: 210 °C(Solv: N,N-dimethylformamide (68-12-2); water (7732-18-5))
• Refractive Index: 1.6
• Boiling Point: 503.3°C at 760 mmHg
• PKA: 2.82±0.70(Predicted)
• Flash Point: 258.2°C
• PSA: 76.11000
• Density: 1.23g/cm³
• LogP: 3.05758
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 254.105527694
• Heavy Atom Count: 19
• Complexity: 502

Purity/Quality:

97% ^*data from raw suppliers

5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2)C(=O)C

Technology Process of 5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile

There total 5 articles about 5-Acetyl-2-amino-6-methyl-4-phenyl-4H-pyran-3-carbonitrile 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: 96.0%

benzaldehyde (100-52-7) + acetoacetic acid methyl ester (105-45-3) + malononitrile (109-77-3) → 5-acetyl-2-amino-3-cyano-6-methyl-4-phenyl-4H-pyran (89809-89-2)

Guidance literature:

With Ferric Sulfasalazine Sulfa Drug Complex Supported on Cobalt Ferrite Cellulose; In ethanol; at 60 ℃; for 0.15h;

DOI:10.1007/s10562-020-03101-6

Reference yield: 95.0%

benzaldehyde (100-52-7) + acetylacetone (123-54-6,81235-32-7) + malononitrile (109-77-3) → 5-acetyl-2-amino-3-cyano-6-methyl-4-phenyl-4H-pyran (89809-89-2)

Guidance literature:

With ClOZn^(1-)*2CH₄N₂O*C₅H₁₄NO⁽¹⁺⁾; In neat liquid; at 20 ℃; for 0.166667h; Reagent/catalyst; Temperature; Solvent; Catalytic behavior;

DOI:10.1007/s13738-017-1144-7

Reference yield: 80.0%

→ 5-acetyl-2-amino-3-cyano-6-methyl-4-phenyl-4H-pyran (89809-89-2)

Guidance literature:

With Candida rugosa lipase; In 1,2-dimethoxyethane; water; at 50 ℃; for 0.5h; Enzymatic reaction;

upstream raw materials:

Benzylidenemalononitrile

acetylacetone

3-benzylidene acetylacetone

malononitrile

Downstream raw materials:

3-Acetyl-5-amino-7-(4-methoxy-phenyl)-2-methyl-4-phenyl-4H,7H-pyrano[2,3-b]pyridine-6,6-dicarbonitrile

5-Amino-3-acetyl-4,7-diphenyl-2-methyl-6,7-dihydro-4H-pyrano<2,3-b>pyridine-6,6-dicarbonitrile

3-acetyl-5-amino-6-cyano-2-methyl-6-methoxycarbonyl-7-(p-methylphenyl)-4-phenyl-6,7-dihydro-4H-pyrano<2,3-b>pyridine

2-amino-3-cyano-5-ethoxycarbonyl-6-methyl-4-phenyl-4H-pyran

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 89809-89-2 5-ACETYL-2-AMINO-6-METHYL-4-PHENYL-4H-PYRAN-3-CARBONITRILE

Send

Send

Metric Ton KG G Pound L ML

Send

Send