2,5,8,11-Tetraoxatridecane-13-thiol

• CAS: 52190-55-3
• Catalog Number: ACM52190553
• Category: Other Products
• Molecular Weight: 224.32g/mol
• Molecular Formula: C9H20O4S
• Synonyms: 2,5,8,11-TETRAOXATRIDECANE-13-THIOL
• IUPAC Name: 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanethiol
• Canonical SMILES: COCCOCCOCCOCCS
• InChI: InChI=1S/C9H20O4S/c1-10-2-3-11-4-5-12-6-7-13-8-9-14/h14H,2-9H2,1H3
• InChI Key: VXEBAWYHFQRROQ-UHFFFAOYSA-N
• Density: 1.035
• Complexity: 103
• Covalently-Bonded Unit Count: 1
• Exact Mass: 224.10823g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 1
• Heavy Atom Count: 14
• Monoisotopic Mass: 224.10823g/mol
• Rotatable Bond Count: 11
• XLogP3: -0.1