N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide

Base Information

• Chemical Name: N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide
• CAS No.: 265989-32-0
• Molecular Formula: C₁₉H₁₉NO₂
• Molecular Weight: 298.326
• Mol file: 265989-32-0.mol

Synonyms:N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide;N-4-Phenyl α-Benzylidene-d5 Isobutyrylacetamide

Chemical Property of N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.622
• Boiling Point: 519.438°C at 760 mmHg
• Flash Point: 188.668°C
• PSA: 46.17000
• Density: 1.172g/cm³
• LogP: 3.25040
• Solubility.: Acetone, Chloroform, Dichloromethane, Ethyl Acetate

Purity/Quality:

97% ^*data from raw suppliers

2-Isobutyryl-N-phenyl-3-phenylacrylamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: An deuterated intermediate of deuterated Atorvastatin, a selective, competitive HMG-CoA reductase inhibitor. The only drug in its class specfically indicated for lowering both elevated LDL-cholestero l and triglycerides in patients with hypercholesterolemia.

Technology Process of N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide

There total 3 articles about N-4-Phenyl a-Benzylidene-d5 Isobutyrylacetamide 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:

aniline-d5 (4165-61-1) → C19H14(2)H5NO2 (265989-32-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 97 percent / toluene / 4 h / 80 °C

2: 15.26 g / β-alanine; glacial acetic acid / hexane / 25 h / Heating

With acetic acid; 3-amino propanoic acid; In hexane; toluene; 1: Acylation / 2: Condensation;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

Reference yield:

isobutyryl Meldrum's acid → C19H14(2)H5NO2 (265989-32-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 97 percent / toluene / 4 h / 80 °C

2: 15.26 g / β-alanine; glacial acetic acid / hexane / 25 h / Heating

With acetic acid; 3-amino propanoic acid; In hexane; toluene; 1: Acylation / 2: Condensation;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

Reference yield:

benzaldehyde (100-52-7) + N-d5-phenyl isobutyrylacetamide (265989-29-5) → C19H14(2)H5NO2 (265989-32-0)

Guidance literature:

With acetic acid; 3-amino propanoic acid; In hexane; for 25h; Heating;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

upstream raw materials:

benzaldehyde

N-d5-phenyl isobutyrylacetamide

aniline-d5

Downstream raw materials:

C₄₀H₄₂⁽²⁾H₅FN₂O₅

atorvastatin-d5

C₂₆H₁₉⁽²⁾H₅FNO₃

Refernces