4-Amino-2,2-dimethyl-4-oxobutanoic acid

Base Information

• Chemical Name: 4-Amino-2,2-dimethyl-4-oxobutanoic acid
• CAS No.: 89531-67-9
• Molecular Formula: C₆H₁₁NO₃
• Molecular Weight: 145.158
• NSC Number: 97172
• DSSTox Substance ID: DTXSID80294581
• Wikidata: Q82033955
• Mol file: 89531-67-9.mol

Synonyms:4-amino-2,2-dimethyl-4-oxobutanoic acid;89531-67-9;NSC 97172;NSC97172;dimethyl succinamic acid;SCHEMBL1699135;DTXSID80294581;NSC-97172;AKOS006339685;3-carbamoyl-2,2-dimethylpropanoic acid;FT-0756371;WOC

Chemical Property of 4-Amino-2,2-dimethyl-4-oxobutanoic acid

Chemical Property:

• Vapor Pressure: 2E-06mmHg at 25°C
• Boiling Point: 368.1°Cat760mmHg
• Flash Point: 176.4°C
• Density: 1.179g/cm³
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 145.07389321
• Heavy Atom Count: 10
• Complexity: 162

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CC(=O)N)C(=O)O

Technology Process of 4-Amino-2,2-dimethyl-4-oxobutanoic acid

There total 2 articles about 4-Amino-2,2-dimethyl-4-oxobutanoic acid 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:

2,2-dimethylsuccinic anhydride (17347-61-4) → 2,2-Dimethyl-bersteinsaeure-4-amid (89531-67-9)

Guidance literature:

With tetrahydrofuran; diethyl ether; ammonia; at -78 ℃;

DOI:10.1021/ja01610a003

Reference yield:

2,2-dimethylsuccinic anhydride (17347-61-4) → 2,2-Dimethyl-bersteinsaeure-4-amid (89531-67-9)

Guidance literature:

With ammonia;

Reference yield:

C21H37N3O5S + 2,2-Dimethyl-bersteinsaeure-4-amid (89531-67-9) → C27H46N4O7S

Guidance literature:

With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide;

upstream raw materials:

2,2-dimethylsuccinic anhydride