s-(11-Bromoundecyl)thioacetate

• CAS: 947150-46-1
• Catalog Number: ACM947150461
• Category: Biomaterials
• Molecular Weight: 309.31g/mol
• Molecular Formula: C13H25BrOS
• Synonyms: S-(11-BroMoundecyl) thioacetate;Thioacetic acid S-(11-bromoundecyl) ester
• IUPAC Name: S-(11-bromoundecyl) ethanethioate
• Canonical SMILES: CC(=O)SCCCCCCCCCCCBr
• InChI: InChI=1S/C13H25BrOS/c1-13(15)16-12-10-8-6-4-2-3-5-7-9-11-14/h2-12H2,1H3
• InChI Key: JEDBIVNXPYJQIU-UHFFFAOYSA-N
• Complexity: 162
• Covalently-Bonded Unit Count: 1
• Exact Mass: 308.08095g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 16
• Monoisotopic Mass: 308.08095g/mol
• Rotatable Bond Count: 12
• XLogP3: 5.6