3-Methyl-4-oxopentane-1,1,2,2-tetracarbonitrile

Base Information

• Chemical Name: 3-Methyl-4-oxopentane-1,1,2,2-tetracarbonitrile
• CAS No.: 90138-08-2
• Molecular Formula: C10H8N4O
• Molecular Weight: 200.2
• DSSTox Substance ID: DTXSID90527418
• Nikkaji Number: J840.697I

Synonyms:3-Methyl-4-oxopentane-1,1,2,2-tetracarbonitrile;90138-08-2;BCQDEKKTHASCKC-UHFFFAOYSA-;DTXSID90527418;4,4,5,5-tetracyano-3-methylpentan-2-one;InChI=1/C10H8N4O/c1-7(8(2)15)10(5-13,6-14)9(3-11)4-12/h7,9H,1-2H3

Chemical Property of 3-Methyl-4-oxopentane-1,1,2,2-tetracarbonitrile

Chemical Property:

• XLogP3: -0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 200.06981089
• Heavy Atom Count: 15
• Complexity: 437

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)C)C(C#N)(C#N)C(C#N)C#N

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