Bisorcic

Base Information

• Chemical Name: Bisorcic
• CAS No.: 39825-23-5
• Molecular Formula: C9H16 N2 O4
• Molecular Weight: 216.237
• European Community (EC) Number: 254-644-4
• UNII: 3V77J79MIF
• DSSTox Substance ID: DTXSID50960387
• Nikkaji Number: J261.454E
• Wikidata: Q27258080
• NCI Thesaurus Code: C74171
• Metabolomics Workbench ID: 199680
• ChEMBL ID: CHEMBL3989425
• Mol file: 39825-23-5.mol

Synonyms:Bisorcic;Bisorcico;Bisorcicum;Bisorcic [INN];39825-23-5;(2S)-2,5-diacetamidopentanoic acid;Bisorcicum [INN-Latin];Bisorcico [INN-Spanish];UNII-3V77J79MIF;N2,N5-Diacetyl_L-ornithine;3V77J79MIF;EINECS 254-644-4;(S)-2,5-Bis(acetamido)valeriansaeure;N(sup 2),N(sup 5)-Diacetyl-L-ornithine;N(2),N(5)-diacetylornithine;N,N'-diacetylornithine;N,N'-diacetyl-ornithine;N2,N5-Diacetylornithine;SCHEMBL2109664;CHEMBL3989425;L-Ornithine, N2,N5-diacetyl-;DTXSID50960387;CHEBI:133217;N(2),N(5)-diacetyl-L-ornithine;N~2~,N~5~-Bis(1-hydroxyethylidene)ornithine;EN300-9430418;Q27258080

Chemical Property of Bisorcic

Chemical Property:

• Vapor Pressure: 3.92E-15mmHg at 25°C
• Boiling Point: 583.6°Cat760mmHg
• PKA: 3.62±0.10(Predicted)
• Flash Point: 306.7°C
• PSA: 102.48000
• Density: 1.175g/cm³
• LogP: 1.17260
• XLogP3: -1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 216.11100700
• Heavy Atom Count: 15
• Complexity: 253

Purity/Quality:

98%Min ^*data from raw suppliers

BISORCIC 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NCCCC(C(=O)O)NC(=O)C
• Isomeric SMILES: CC(=O)NCCC[C@@H](C(=O)O)NC(=O)C

Technology Process of Bisorcic

There total 1 articles about Bisorcic 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:

L-ornithine (70-26-8,25104-12-5,410523-47-6) + acetic anhydride (108-24-7) → Nα,Nδ-diacetyl-L-ornithine (39825-23-5)

Guidance literature:

With sodium hydroxide;

upstream raw materials:

L-ornithine

acetic anhydride