3-Heptylthiophene

• CAS: 65016-61-7
• Catalog Number: ACM65016617
• Category: Other Products
• Molecular Weight: 182.33g/mol
• Molecular Formula: C11H18S
• IUPAC Name: 3-heptylthiophene
• Canonical SMILES: CCCCCCCC1=CSC=C1
• InChI: InChI=1S/C11H18S/c1-2-3-4-5-6-7-11-8-9-12-10-11/h8-10H,2-7H2,1H3
• InChI Key: IUUMHORDQCAXQU-UHFFFAOYSA-N
• Complexity: 101
• Covalently-Bonded Unit Count: 1
• Exact Mass: 182.112922g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 12
• Monoisotopic Mass: 182.112922g/mol
• Rotatable Bond Count: 6
• XLogP3: 5.5