(5-(4-Fluorophenyl)thiophen-2-yl)(5-iodo-2-methylphenyl)methanone

• Catalog: OFC1071929082
• CAS: 1071929-08-2
• Category: Fluorinated Thiophenes
• Synonyms: 2-(5-Iodo-2-methylbenzoyl)-5-(4-fluorophenyl)thiophene
• Purity: 95%
• MDL Number: MFCD12405594

• IUPAC Name: [5-(4-fluorophenyl)thiophen-2-yl]-(5-iodo-2-methylphenyl)methanone
• InChI: InChI=1S/C18H12FIOS/c1-11-2-7-14(20)10-15(11)18(21)17-9-8-16(22-17)12-3-5-13(19)6-4-12/h2-10H,1H3
• InChI Key: UCEUYWYTFYVWBY-UHFFFAOYSA-N
• Isomeric SMILES: CC1=C(C=C(C=C1)I)C(=O)C2=CC=C(S2)C3=CC=C(C=C3)F
• EC Number: 924-156-2

• Molecular Formula: C18H12FIOS
• Molecular Weight: 422.26

• XLogP3-AA: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 421.96376 g/mol
• Monoisotopic Mass: 421.96376 g/mol
• Topological Polar Surface Area: 45.3Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 397