N-[(2R)-2-Cyano-3-methyl-2-butanyl]-5-methyl-1,2-oxazole-4-carboxamide
[CAS# 828940-68-7]

Identification

• Name: N-[(2R)-2-Cyano-3-methyl-2-butanyl]-5-methyl-1,2-oxazole-4-carboxamide
• Molecular Formula: C₁₁H₁₅N₃O₂
• Molecular Weight: 221.26
• CAS Registry Number: 828940-68-7
• SMILES: Cc1oncc1C(/O)=N/[C@@](C)(C#N)C(C)C
• InChI: 1S/C11H15N3O2/c1-7(2)11(4,6-12)14-10(15)9-5-13-16-8(9)3/h5,7H,1-4H3,(H,14,15)/t11-/m0/s1
• InChIKey: KIEDOHHFMPEVRX-NSHDSACASA-N

Properties

• Density: 1.146g/cm³ (Cal.)
• Boiling point: 389.409°C at 760 mmHg (Cal.)
• Flash point: 189.308°C (Cal.)
• Refractive index: 1.541 (Cal.)

References

• (1): B. Zhong, X.-L. Mu, Z.-M. Li and H.-B. Song. N-(1-Cyano-1,2-dimethylpropyl)-5-methylisoxazole-4-carboxamide, Acta Cryst. (2004). E60, o1797-o1799