Cafenstrole

• Catalog Number: ACM125306834
• Product Name: Cafenstrole
• CAS: 125306-83-4
• Category: Heterocyclic Organic Compound
• Synonyms: Cafenstrole, Cafenstrole [ISO], CID195429, 1H-1,2,4-Triazole-1-carboxamide, N,N-diethyl-3-mesitylsulfonyl-, N,N-Diethyl-3-mesitylsulfonyl-1H-1,2,4-triazole-1-carboxamide, 125306-83-4
• IUPAC Name: N,N-diethyl-3-(2,4,6-trimethylphenyl)sulfonyl-1,2,4-triazole-1-carboxamide
• Molecular Weight: 350.44
• Molecular Formula: C₁₆H₂₂N₄O₃S
• Canonical SMILES: CCN(CC)C(=O)N1C=NC(=N1)S(=O)(=O)C2=C(C=C(C=C2C)C)C
• InChI Key: HFEJHAAIJZXXRE-UHFFFAOYSA-N
• Boiling Point: 525.4ºC at 760mmHg
• Melting Point: 115ºC
• Flash Point: 271.5ºC
• Density: 1.26g/cm³
• EC Number: 603-054-9
• Exact Mass: 350.14100
• H-Bond Acceptor: 5
• H-Bond Donor: 0