2-(3-Chlorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile

Base Information

• Chemical Name: 2-(3-Chlorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile
• CAS No.: 338982-39-1
• Molecular Formula: C10H5ClN4O2
• Molecular Weight: 248.62
• DSSTox Substance ID: DTXSID501139982
• Mol file: 338982-39-1.mol

Synonyms:2-(3-chlorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile;338982-39-1;2-(3-chlorophenyl)-3,5-dioxo-1,2,4-triazine-6-carbonitrile;Oprea1_869135;DTXSID501139982;MFCD00794270;AKOS005070648;SB73419;CS-0364491;5K-917;A912353;2-(3-Chlorophenyl)-2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazine-6-carbonitrile

Chemical Property of 2-(3-Chlorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 248.0101031
• Heavy Atom Count: 17
• Complexity: 439

Purity/Quality:

98%min ^*data from raw suppliers

2-(3-Chlorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Cl)N2C(=O)NC(=O)C(=N2)C#N