N-(2-Cyano-3-methylbutan-2-yl)-5-methyl-1,2-oxazole-4-carboxamide

Base Information

• Chemical Name: N-(2-Cyano-3-methylbutan-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
• CAS No.: 828940-68-7
• Molecular Formula: C11H15N3O2
• Molecular Weight: 221.25600
• DSSTox Substance ID: DTXSID90700365
• Mol file: 828940-68-7.mol

Synonyms:828940-68-7;N-(2-Cyano-3-methylbutan-2-yl)-5-methylisoxazole-4-carboxamide;N-(2-Cyano-3-methylbutan-2-yl)-5-methyl-1,2-oxazole-4-carboxamide;DTXSID90700365

Chemical Property of N-(2-Cyano-3-methylbutan-2-yl)-5-methyl-1,2-oxazole-4-carboxamide

Chemical Property:

• PSA: 82.41000
• LogP: 2.22588
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 221.116426730
• Heavy Atom Count: 16
• Complexity: 320

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=NO1)C(=O)NC(C)(C#N)C(C)C