N-carbamoyl-L-aspartate

Base Information

• Chemical Name: N-carbamoyl-L-aspartate
• CAS No.: 13184-27-5
• Molecular Formula: C5H8N2O5
• Molecular Weight: 176.129
• Hs Code.: 2924199090
• European Community (EC) Number: 236-134-3
• UNII: R2521024DK
• DSSTox Substance ID: DTXSID30864374
• Nikkaji Number: J39.568D
• Wikidata: Q55177068
• Metabolomics Workbench ID: 78599
• Mol file: 13184-27-5.mol

Synonyms:carbamyl-DL-aspartate;carbamylaspartic acid;N-carbamoyl-D-aspartic acid;N-carbamoyl-L-aspartic acid;N-carbamoylaspartic acid;N-carbamoylaspartic acid, D-;N-carbamoylaspartic acid, DL-;ureidosuccinic acid;ureidosuccinic acid, (D)-isomer;ureidosuccinic acid, (L)-isomer;ureidosuccinic acid, cobalt (+2), (1:1) salt,(L)-isomer;ureidosuccinic acid, maganeese (+2), (1:1) salt;ureidosuccinic acid, zinc (1:1) salt, (L)-isomer

Chemical Property of N-carbamoyl-L-aspartate

Chemical Property:

• Vapor Pressure: 2.27E-06mmHg at 25°C
• Melting Point: 174 - 175oC
• Refractive Index: 1.556
• Boiling Point: 366.4 °C at 760 mmHg
• Flash Point: 175.4 °C
• PSA: 129.72000
• Density: 1.596 g/cm³
• LogP: -0.32620
• Storage Temp.: 2-8°C
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 176.04332136
• Heavy Atom Count: 12
• Complexity: 214

Purity/Quality:

99% ^*data from raw suppliers

Carbamoyl-Asp-OH·magnesiumsalt/Carbamoyl-Asp-OH·dipotassiumsalt(1:1) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Biological Agents -> Amino Acids and Derivatives
• Canonical SMILES: C(C(C(=O)O)NC(=O)N)C(=O)O
• Isomeric SMILES: C([C@@H](C(=O)O)NC(=O)N)C(=O)O
• Recent ClinicalTrials: Dietary Effects on Weight Loss and Lipid Profile in Sedentary Men

Technology Process of N-carbamoyl-L-aspartate

There total 1 articles about N-carbamoyl-L-aspartate 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:

potassium cyanate (590-28-3) + L-Aspartic acid (56-84-8,25608-40-6,27881-03-4,32505-46-7,52526-39-3) → [13C]-N-carbamoylaspartate (13184-27-5)

Guidance literature:

With potassium hydroxide;

DOI:10.1248/cpb.15.1604 DOI:10.1021/ja01198a042

upstream raw materials:

potassium cyanate

L-Aspartic acid

Refernces