Pentizidone
[CAS# 55694-83-2]

Identification

• Name: Pentizidone
• Synonyms: (4R)-4-[[(E)-1-Methyl-3-Oxo-But-1-Enyl]Amino]Isoxazolidin-3-One; (4R)-4-[[(E)-1-Methyl-3-Oxobut-1-Enyl]Amino]-3-Isoxazolidinone; (4R)-4-[[(E)-3-Keto-1-Methyl-But-1-Enyl]Amino]Isoxazolidin-3-One
• Molecular Formula: C₈H₁₂N₂O₃
• Molecular Weight: 184.19
• CAS Registry Number: 55694-83-2
• SMILES: [C@H]1(NC(=C/C(=O)C)/C)C(=O)NOC1
• InChI: 1S/C8H12N2O3/c1-5(3-6(2)11)9-7-4-13-10-8(7)12/h3,7,9H,4H2,1-2H3,(H,10,12)/b5-3+/t7-/m1/s1
• InChIKey: DGYLXKOLHICICX-OHCKJTPYSA-N

Properties

• Density: 1.21g/cm³ (Cal.)