2,3-Diaminopropionic acid

Base Information

• Chemical Name: 2,3-Diaminopropionic acid
• CAS No.: 515-94-6
• Deprecated CAS: 6018-54-8
• Molecular Formula: C3H8N2O2
• Molecular Weight: 104.109
• Hs Code.: 2922499990
• NSC Number: 115849
• UNII: 8908T5BN6R
• DSSTox Substance ID: DTXSID90863308
• Nikkaji Number: J38.128D
• Wikipedia: 2,3-Diaminopropionic_acid
• Wikidata: Q27103042
• ChEMBL ID: CHEMBL596011
• Mol file: 515-94-6.mol

Synonyms:2,3-diaminopropanoic acid;2,3-diaminopropionic acid;2,3-diaminopropionic acid, (D)-isomer;2,3-diaminopropionic acid, (DL)-isomer;2,3-diaminopropionic acid, (DL)-isomer, monohydrochloride;2,3-diaminopropionic acid, (L)-isomer;2,3-diaminopropionic acid, (L)-isomer, monohydrochloride;2-amino-beta-alanine;3-aminoalanine;alpha,beta-diaminopropionic acid;beta-aminoalanine

Chemical Property of 2,3-Diaminopropionic acid

Chemical Property:

• Melting Point: 110°C
• Refractive Index: 1.4715 (estimate)
• Boiling Point: 325.6 °C at 760 mmHg
• PKA: pK1:1.33(+2);pK2:6.674(+1);pK3:9.623(0) (25°C,μ=0.1)
• Flash Point: 150.7 °C
• PSA: 89.34000
• Density: 1.294 g/cm³
• LogP: -0.24240
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: -4.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 104.058577502
• Heavy Atom Count: 7
• Complexity: 73.3

Purity/Quality:

99% ^*data from raw suppliers

2,3-DiaminopropanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Nitrogen Compounds -> Amino Carboxylic Acids
• Canonical SMILES: C(C(C(=O)O)N)N

Technology Process of 2,3-Diaminopropionic acid

There total 56 articles about 2,3-Diaminopropionic 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:

haloirciniamide A → (S)-2,3-diaminopropionic acid (515-94-6,1915-96-4,4033-39-0,6018-54-8) + L-isoserine (565-71-9,632-11-1,632-12-2,632-13-3) + (2R)-aspartic acid (1783-96-6,25608-40-6,27881-03-4,32505-46-7,52526-39-3)

Guidance literature:

haloirciniamide A; With hydrogenchloride; In water; at 110 ℃; for 15h;

With sodium hydrogencarbonate; N-(2,4-dinitro-5-fluorophenyl)-L-alaninamide; In water; acetone; at 40 ℃; for 1h;

DOI:10.3390/MD18080396

Reference yield:

→ 2,3-diaminopropanoic acid (515-94-6)

Guidance literature:

With hydrogenchloride;

DOI:10.1021/ja01621a071

Reference yield:

2,3-dibromopropionic acid (600-05-5) → 2,3-diaminopropanoic acid (515-94-6)

Guidance literature:

With ammonia;

upstream raw materials:

2,3-dibromopropionic acid

acetylamino-(benzoylamino-methyl)-malonic acid dimethyl ester

2-(S)-benzyloxycarbonylamino-3-aminopropionic acid

Boc-Dap(NH₂)-CONH₂

Downstream raw materials:

α-amino-β-guanidinopropionic acid

(S)-2,3-diaminopropionic acid

glyceric acid

aminoacetaldehyde

Refernces

• 1、 Shin, Yern-Hyerk,Ban, Yeon Hee,Kim, Tae Ho,Bae, Eun Seo,Shin, Jongheon,Lee, Sang Kook,Jang, Jichan,Yoon, Yeo Joon,Oh, Dong-Chan. "Structures and Biosynthetic Pathway of Coprisamides C and D, 2-Alkenylcinnamic Acid-Containing Peptides from the Gut Bacterium of the Carrion Beetle Silpha perforata". . . Retrieved 2021/02/26.
• 2、 -. "Immunomodulatory peptides". . . Retrieved 2014/12/12.