Pseudoisocytidine

Base Information

• Chemical Name: Pseudoisocytidine
• CAS No.: 57100-18-2
• Molecular Formula: C9H13 N3 O5
• Molecular Weight: 243.219
• UNII: TDH73L8XQD
• DSSTox Substance ID: DTXSID20205717
• Nikkaji Number: J82.401A
• Wikidata: Q15632736
• NCI Thesaurus Code: C87389
• Mol file: 57100-18-2.mol

Synonyms:5-(beta-D-ribofuranosyl)isocytosine;pseudoisocytidine;pseudoisocytidine monohydrochloride;psi-isocytidine

Chemical Property of Pseudoisocytidine

Chemical Property:

• Vapor Pressure: 6.96E-15mmHg at 25°C
• Boiling Point: 560.2°Cat760mmHg
• Flash Point: 292.6°C
• PSA: 141.69000
• Density: 1.98g/cm³
• LogP: -1.91270
• Storage Temp.: 2-8°C
• XLogP3: -3.1
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 243.08552052
• Heavy Atom Count: 17
• Complexity: 394

Purity/Quality:

98%Min ^*data from raw suppliers

Pseudoisocytidine 97+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=O)NC(=N1)N)C2C(C(C(O2)CO)O)O
• Isomeric SMILES: C1=C(C(=O)NC(=N1)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O

Technology Process of Pseudoisocytidine

There total 3 articles about Pseudoisocytidine 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:

2-amino-4-chloro-5-(β-D-ribofuranosyl)pyrimidine (68168-20-7) → pseudoisocytidine (57100-18-2)

Guidance literature:

With sodium acetate; In water;

Reference yield:

→ pseudoisocytidine (57100-18-2)

Guidance literature:

1,3-Dimethylpseudouridin (VIII),Guanidin-HCl;

DOI:10.1021/jo00400a037

Reference yield:

→ pseudoisocytidine (57100-18-2)

Guidance literature:

upstream raw materials:

2-amino-4-chloro-5-(β-D-ribofuranosyl)pyrimidine

Downstream raw materials:

pseudouridine

Refernces

• 1、 -. "Pyrimidine to pyrimidine transformation process". . . Retrieved 2008/06/13.