beta-Ureidoalanine

Base Information

• Chemical Name: beta-Ureidoalanine
• CAS No.: 1483-07-4
• Molecular Formula: C4H9N3O3
• Molecular Weight: 147.134
• Hs Code.: 2924199090
• Mol file: 1483-07-4.mol

Synonyms:beta-ureidoalanine;(2S)-2-amino-3-(carbamoylamino)propanoate

Chemical Property of beta-Ureidoalanine

Chemical Property:

• Appearance/Colour: White powder
• Vapor Pressure: 3.95E-06mmHg at 25°C
• Melting Point: 217 °C (dec.)
• Refractive Index: 1.55
• Boiling Point: 359.116 °C at 760 mmHg
• PKA: 2.15±0.10(Predicted)
• Flash Point: 170.987 °C
• PSA: 118.44000
• Density: 1.43 g/cm³
• LogP: -0.14190
• Storage Temp.: 2-8°C
• Solubility.: Methanol (Slightly), Water (Slightly)
• XLogP3: -4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 147.06439116
• Heavy Atom Count: 10
• Complexity: 141

Purity/Quality:

98%min ^*data from raw suppliers

L-Albizzine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(C(C(=O)[O-])[NH3+])NC(=O)N
• Isomeric SMILES: C([C@@H](C(=O)[O-])[NH3+])NC(=O)N
• Uses: Albizziin is a glutamase inhibitor, a glutaminyl-tRNA synthetase inhibitor as well as an intermediate in the synthesis of heterocycles. It is also a potential effector group in affinity chromatography

Technology Process of beta-Ureidoalanine

There total 6 articles about beta-Ureidoalanine 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: 70.0%

β-Ureido-L-α-tosylamino-propionsaeure (91338-47-5) → L-2-Amino-3-ureido-propanoic acid (1483-07-4)

Guidance literature:

With hydrogen bromide; acetic acid; phenol; for 96h;

DOI:10.1021/jm00146a008

Reference yield:

quisqualic acid (52809-07-1) → L-2-Amino-3-ureido-propanoic acid (1483-07-4)

Guidance literature:

With hydrogen; platinum(IV) oxide; In water; at 20 ℃; for 3h;

DOI:10.1039/c39850000256

Reference yield:

β-(3-hydroxyureido)-L-alanine (56073-44-0,56095-16-0,56645-92-2) → L-2-Amino-3-ureido-propanoic acid (1483-07-4)

Guidance literature:

With hydrogen; platinum(IV) oxide; In water;

DOI:10.1248/cpb.23.2669

upstream raw materials:

potassium cyanate

(S)-2,3-diaminopropionic acid

β-(3-hydroxyureido)-L-alanine

β-Ureido-L-α-tosylamino-propionsaeure

Downstream raw materials:

(S)-2-[4-(Benzyloxycarbonyl-methyl-amino)-benzoylamino]-3-ureido-propionic acid

(S)-2-benzoylamino-3-ureido-propionic acid methyl ester

Refernces

• 1、 Piper, J. R.,McCaleb, G. S.,Montgomery, J. A.,Schmid, F. A.,Sirotnak, F. M.. "Syntheses and Evaluation as Antifolates of MTX Analogues Derived from 2,ω-Diaminoalkanoic Acids". . p. 1016 - 1025. Retrieved 2007/10/02.