2-(carbamoylamino)butanoic Acid

Base Information

• Chemical Name: 2-(carbamoylamino)butanoic Acid
• CAS No.: 55512-98-6
• Molecular Formula: C5H10N2O3
• Molecular Weight: 146.146
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID20399261
• Mol file: 55512-98-6.mol

Synonyms:2-(carbamoylamino)butanoic Acid;55512-98-6;2-[(aminocarbonyl)amino]butanoic acid;N-Carbamyl-DL-alpha-amino-n-butyric acid;2-Ureidobutanoic acid;ureidobutyric acid;2-Ureidobutanoicacid;SCHEMBL5475677;DTXSID20399261;HMS1783D16;AKOS008045801;CS-0233619;FT-0691501;EN300-13497;Z90663559

Chemical Property of 2-(carbamoylamino)butanoic Acid

Chemical Property:

• PSA: 93.41000
• LogP: 0.42260
• Storage Temp.: 2-8°C
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 146.06914219
• Heavy Atom Count: 10
• Complexity: 146

Purity/Quality:

98%Min ^*data from raw suppliers

N-Carbamyl-DL-α-amino-N-butyricAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C(=O)O)NC(=O)N

Technology Process of 2-(carbamoylamino)butanoic Acid

There total 1 articles about 2-(carbamoylamino)butanoic 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-bromobutyric acid ethyl ester (533-68-6) → N-carbamoyl-D,L-ABA (55512-98-6)

Guidance literature:

With ethanol; ammonia; at 100 ℃; unter Druck; anschliessend ueber mehrere Stufen;

Reference yield:

N-carbamoyl-D,L-ABA (55512-98-6) → L-2-aminobutyric acid (1492-24-6)

Guidance literature:

With water; cobalt(II) chloride; for 10.8h; pH=8; Enzymatic reaction;

DOI:10.1016/j.procbio.2014.04.013

Reference yield:

N-carbamoyl-D,L-ABA (55512-98-6) → 5-ethyl hydantoin (15414-82-1,525599-49-9,685885-71-6)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

2-bromobutyric acid ethyl ester

Downstream raw materials:

5-ethyl hydantoin

L-2-aminobutyric acid