3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbaldehyde

Base Information

• Chemical Name: 3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbaldehyde
• CAS No.: 97776-60-8
• Molecular Formula: C4H3N3O3
• Molecular Weight: 141.08500
• DSSTox Substance ID: DTXSID00604648
• Wikidata: Q82502650
• Mol file: 97776-60-8.mol

Synonyms:97776-60-8;2,3,4,5-Tetrahydro-3,5-dioxo-1,2,4-triazine-6-carboxaldehyde;1,2,4-Triazine-6-carboxaldehyde, 2,3,4,5-tetrahydro-3,5-dioxo-;SCHEMBL4083560;DTXSID00604648;3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbaldehyde;DB-267251;1,2,4-Triazine-6-carboxaldehyde,2,3,4,5-tetrahydro-3,5-dioxo-(9ci)

Chemical Property of 3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbaldehyde

Chemical Property:

• PSA: 96.20000
• LogP: -0.90470
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 141.01744097
• Heavy Atom Count: 10
• Complexity: 232

Purity/Quality:

2,3,4,5-Tetrahydro-3,5-dioxo-1,2,4-triazine-6-carboxaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)C1=NNC(=O)NC1=O
• Uses: 2,3,4,5-Tetrahydro-3,5-dioxo-1,2,4-triazine-6-carboxaldehyde, can be used in the synthesis of 5-halovinyl-6-aza-2''-deoxyuridines, having antiviral activity.

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