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Isocytosine

Base Information Edit
  • Chemical Name:Isocytosine
  • CAS No.:108-53-2
  • Molecular Formula:C4H5N3O
  • Molecular Weight:111.103
  • Hs Code.:29335990
  • European Community (EC) Number:203-592-0
  • NSC Number:49118
  • DSSTox Substance ID:DTXSID00148350
  • Nikkaji Number:J2.864I
  • Wikipedia:Isocytosine
  • Wikidata:Q10859790
  • Metabolomics Workbench ID:52593
  • ChEMBL ID:CHEMBL56260
  • Mol file:108-53-2.mol
Isocytosine

Synonyms:isocytosine

Suppliers and Price of Isocytosine
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • Usbiological
  • Isocytosine
  • 10g
  • $ 375.00
  • Usbiological
  • Isocytosine
  • 10g
  • $ 375.00
  • TRC
  • IsoCytosine
  • 25g
  • $ 135.00
  • TCI Chemical
  • Isocytosine >98.0%(HPLC)(T)
  • 5g
  • $ 162.00
  • SynQuest Laboratories
  • Isocytosine
  • 1 g
  • $ 33.00
  • SynQuest Laboratories
  • Isocytosine
  • 5 g
  • $ 55.00
  • SynQuest Laboratories
  • Isocytosine
  • 25 g
  • $ 180.00
  • Sigma-Aldrich
  • Isocytosine ≥99%
  • 5g
  • $ 141.00
  • Sigma-Aldrich
  • Isocytosine ≥99%
  • 25g
  • $ 489.00
  • Medical Isotopes, Inc.
  • Isocytosine
  • 50 g
  • $ 1720.00
Total 112 raw suppliers
Chemical Property of Isocytosine Edit
Chemical Property:
  • Appearance/Colour:white to off-white solid 
  • Vapor Pressure:0.019mmHg at 25°C 
  • Melting Point:275 °C 
  • Refractive Index:1.688 
  • Boiling Point:252.7 °C at 760 mmHg 
  • PKA:9.59±0.40(Predicted) 
  • Flash Point:106.7 °C 
  • PSA:72.03000 
  • Density:1.55 g/cm3 
  • LogP:0.34560 
  • Storage Temp.:Room temperature. 
  • Solubility.:DMSO (Slightly) 
  • Water Solubility.:Soluble in DMF, DMSO, hot water, and AcOH. 
  • XLogP3:-1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Rotatable Bond Count:0
  • Exact Mass:111.043261792
  • Heavy Atom Count:8
  • Complexity:170
Purity/Quality:

99% *data from raw suppliers

Isocytosine *data from reagent suppliers

Safty Information:
  • Pictogram(s): IrritantXi 
  • Hazard Codes:Xn 
  • Statements: 22-36 
  • Safety Statements: 26 
MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:
  • Canonical SMILES:C1=CN=C(NC1=O)N
  • Uses Isocytosine is a useful intermediate for chemical modifications of base and sugar moieties in natural nucleosides Isocytosine (2-aminouracil) is an isomer of cytosine used in physical chemical studies involving metal complex binding, hydrogen-bonding, and tautomerism and proton transfer effects in nucleobases.
Technology Process of Isocytosine

There total 40 articles about Isocytosine 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:
Guidance literature:
With Agrobacterium sp. DSM 6136; for 48h;
DOI:10.1016/S0040-4020(97)00301-3
Guidance literature:
With N-Bromosuccinimide; In water; 1.) RT, 1 h, 2.) 80 deg C, 1 h;
DOI:10.1248/cpb.40.235
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