1-(4'-Iodophenyl)butane

• CAS: 20651-67-6
• Catalog Number: ACM20651676
• Category: Other Products
• Molecular Weight: 260.11g/mol
• Molecular Formula: C10H13I
• IUPAC Name: 1-butyl-4-iodobenzene
• Canonical SMILES: CCCCC1=CC=C(C=C1)I
• InChI: InChI=1S/C10H13I/c1-2-3-4-9-5-7-10(11)8-6-9/h5-8H,2-4H2,1H3
• InChI Key: XILRUONFYBUYIE-UHFFFAOYSA-N
• Complexity: 93
• Covalently-Bonded Unit Count: 1
• Exact Mass: 260.0062g/mol
• Formal Charge: 0
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 11
• Monoisotopic Mass: 260.0062g/mol
• Rotatable Bond Count: 3
• XLogP3: 4.5