Ureidosuccinic acid

Base Information

• Chemical Name: Ureidosuccinic acid
• CAS No.: 923-37-5
• Molecular Formula: C₅H₈N₂O₅
• Molecular Weight: 176.129
• Hs Code.: 2924199090
• European Community (EC) Number: 213-096-6
• NSC Number: 120033,14983
• UNII: O3Y2KY16L1
• DSSTox Substance ID: DTXSID701030182
• Nikkaji Number: J2.382.250D
• Wikipedia: Carbamoyl_aspartic_acid
• Wikidata: Q2823324
• Metabolomics Workbench ID: 63548
• ChEMBL ID: CHEMBL1161506
• Mol file: 923-37-5.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 Ureidosuccinic acid

Chemical Property:

• Appearance/Colour: white Crystalline powder
• Vapor Pressure: 2.27E-06mmHg at 25°C
• Melting Point: ~175 °C (dec.)
• Refractive Index: 1.4472 (estimate)
• Boiling Point: 366.4 °C at 760 mmHg
• PKA: 3.65±0.23(Predicted)
• Flash Point: 175.4 °C
• PSA: 129.72000
• Density: 1.596 g/cm³
• LogP: -0.32620
• Storage Temp.: Store at 2-8
• Solubility.: Aqueous Acid (Slightly), DMSO (Slightly)
• Water Solubility.: Soluble in hot water.
• 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:

97% ^*data from raw suppliers

N-Carbamoyl-DL-aspartic Acid ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(=O)O)NC(=O)N)C(=O)O
• Uses: N-Carbamoyl-DL-aspartic acid, is a useful biochemical for proteomics research. It is also used as a carbamate derivative which serves as an intermediate in pyrimidine biosynthesis.

Technology Process of Ureidosuccinic acid

There total 8 articles about Ureidosuccinic 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: 53.0%

potassium cyanate + aspartic Acid (617-45-8,25608-40-6,27881-03-4,32505-46-7,52526-39-3) → ureidosuccinic acid (923-37-5,173298-46-9)

Guidance literature:

With potassium hydroxide; Mechanism; also (2,S,3S)-methylaspartic acid;

Reference yield:

2-carbamimidoyloxy-succinic acid → ureidosuccinic acid (923-37-5,173298-46-9)

Guidance literature:

In water; Heating;

DOI:10.1246/bcsj.75.855

Reference yield:

4,5-dihydroorotic acid (155-54-4,6202-10-4) → ureidosuccinic acid (923-37-5,173298-46-9)

Guidance literature:

With sodium hydroxide; In water; at 25 ℃; Rate constant; Mechanism; var. pH;

upstream raw materials:

potassium cyanate

aspartic Acid

L-Aspartic acid

urea

Downstream raw materials:

orotic acid

5-hydantoinacetic acid