Pyracarbolid
[CAS# 24691-76-7]

Identification

• Classification: Chemical pesticide >> Fungicide >> Other fungicides
• Name: Pyracarbolid
• Synonyms: 2-Methyl-5,6-Dihydro-4,4-Pyran-3-Carbonsaeureanilid [German]; 2-Methyl-5,6-Dihydro-4-H-Pyrane-3-Carboxylic Acid Anilide; 3,4-Dihydro-6-Methyl-2H-Pyran-5-Carboxanilide
• Molecular Formula: C₁₃H₁₅NO₂
• Molecular Weight: 217.27
• CAS Registry Number: 24691-76-7
• EINECS: 246-419-4
• SMILES: C2=C(NC(=O)C1=C(OCCC1)C)C=CC=C2
• InChI: 1S/C13H15NO2/c1-10-12(8-5-9-16-10)13(15)14-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H,14,15)
• InChIKey: YPCALTGLHFLNGA-UHFFFAOYSA-N

Properties

• Density: 1.172g/cm³ (Cal.)
• Boiling point: 392.537°C at 760 mmHg (Cal.)
• Flash point: 191.2°C (Cal.)

References

• (1): Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493