1-[(3-Pyridylamino)methyl]pyrrolidine-2,5-dione

Base Information

• Chemical Name: 1-[(3-Pyridylamino)methyl]pyrrolidine-2,5-dione
• CAS No.: 5139-22-0
• Molecular Formula: C10H11N3O2
• Molecular Weight: 205.2132
• DSSTox Substance ID: DTXSID90965699
• Wikidata: Q82948000
• ChEMBL ID: CHEMBL1332839

Synonyms:5139-22-0;1-[(3-pyridylamino)methyl]pyrrolidine-2,5-dione;CDS1_000594;Maybridge1_002882;Oprea1_230588;Oprea1_765513;MLS000105060;DivK1c_001634;1-{[(pyridin-3-yl)amino]methyl}pyrrolidine-2,5-dione;CHEMBL1332839;HMS549K22;DTXSID90965699;HMS2344C10;CCG-50968;AKOS000641160;SMR000054989;1-[(3-pyridinylamino)methyl]-2,5-pyrrolidinedione;SR-01000609786-2;Z56755260

Chemical Property of 1-[(3-Pyridylamino)methyl]pyrrolidine-2,5-dione

Chemical Property:

• Vapor Pressure: 4.21E-10mmHg at 25°C
• Boiling Point: 499.3°Cat760mmHg
• Flash Point: 255.7°C
• Density: 1.359g/cm³
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 205.085126602
• Heavy Atom Count: 15
• Complexity: 251

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)N(C1=O)CNC2=CN=CC=C2

Technology Process of 1-[(3-Pyridylamino)methyl]pyrrolidine-2,5-dione

There total 6 articles about 1-[(3-Pyridylamino)methyl]pyrrolidine-2,5-dione 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:

1-Brom-1-methylmercapto-al-D-galaktose-pentaacetat (5077-36-1,5120-87-6) → L-O1,O2,O3,O4,O5-pentaacetyl-O6-ethyl-galactitol (5139-22-0,5139-26-4,59921-39-0,59953-26-3,59953-39-8)

Guidance literature:

Multi-step reaction with 2 steps

1: Ag₂CO₃

2: Raney-Ni / diethyl ether / Heating

With silver carbonate; nickel; In diethyl ether;

Reference yield:

Penta-O-acetyl-D-galaktose-dimethylmercaptal (5077-32-7) → L-O1,O2,O3,O4,O5-pentaacetyl-O6-ethyl-galactitol (5139-22-0,5139-26-4,59921-39-0,59953-26-3,59953-39-8)

Guidance literature:

Multi-step reaction with 3 steps

1: Br₂ / diethyl ether

2: Ag₂CO₃

3: Raney-Ni / diethyl ether / Heating

With bromine; silver carbonate; nickel; In diethyl ether;

Reference yield:

acetic anhydride (108-24-7) + (2S,3R,4R,5R)-6-Ethoxy-hexane-1,2,3,4,5-pentaol (5139-30-0,5139-33-3) → Acetic acid (1R,2R,3S)-2,3,4-triacetoxy-1-((R)-1-acetoxy-2-ethoxy-ethyl)-butyl ester (5139-22-0,5139-26-4,59921-39-0,59953-26-3,59953-39-8)

Guidance literature:

With pyridine; at 100 ℃; for 0.25h;

DOI:10.1016/0008-6215(88)85067-5

upstream raw materials:

penta-O-acetyl-aldehydo-D-glucose (Ξ)-O-ethyl S-methyl monothioacetal

2,3,4,5,6-penta-O-acetyl-D-glucose dimethyl dithioacetal

penta-O-acetyl-aldehydo-D-galactose (Ξ)-O-ethyl S-methyl monothioacetal

1-Brom-1-methylmercapto-al-D-galaktose-pentaacetat

Downstream raw materials:

1-Aethyl-D-dulcit

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