Methyltri-n-octylammonium Hydrogen Sulfate

• CAS: 59158-14-4
• Catalog Number: ACM59158144
• Category: Other Products
• Molecular Weight: 465.778g/mol
• Molecular Formula: C25H55NO4S
• Synonyms: UNII-WK5C0BIA55; C25H55NO4S; AK289418; CTK1G9320; X6769; M1457; 59158-14-4; TR-020531; N-Methyl-N,N-dioctyloctan-1-aminium hydrogensulfate; AKOS015856739
• IUPAC Name: hydrogen sulfate;methyl(trioctyl)azanium
• Canonical SMILES: CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.OS(=O)(=O)[O-]
• InChI: InChI=1S/C25H54N.H₂O4S/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;1-5(2,3)4/h5-25H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
• InChI Key: MWSPFHZPVVWJCO-UHFFFAOYSA-M
• Complexity: 296
• Covalently-Bonded Unit Count: 2
• Exact Mass: 465.385g/mol
• H-Bond Acceptor: 4
• H-Bond Donor: 1
• Heavy Atom Count: 31
• Monoisotopic Mass: 465.385g/mol
• Rotatable Bond Count: 21
• Topological Polar Surface Area: 85.8A^2
• UNII: WK5C0BIA55