1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate
TL;DR: 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate (CAS 460345-16-8) is a chemical compound with molecular formula C11H19F3N2O3S and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexyl-3-methylimidazol-3-ium;trifluoromethanesulfonate
Also Known As: 1-HEXYL-3-METHYLIMIDAZOLIUM TRIFLUOROMETHANESULFONATE, [hmim]otf, 1-hexyl-3-methylimidazolium triflate, 1-Hexyl-3-methylimidazolium trifluoromethansulfonate, Tox21_200101
| Molecular Formula | C11H19F3N2O3S |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | 1.9443 |
| Topological Polar Surface Area | 66.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.10684 |
| Heavy Atoms | 20 |
| Complexity | 483.34793 |
Chemical Identifiers
| CAS Number | 460345-16-8 |
|---|---|
| SMILES | CCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-] |
Product Overview
1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate (CAS 460345-16-8), with molecular formula C11H19F3N2O3S and molecular weight 316.11 g/mol. IUPAC: 1-hexyl-3-methylimidazol-3-ium;trifluoromethanesulfonate.
Chemical Property Profile of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate
Property Insights of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate
The XLogP value of 1.9443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate. The TPSA of 66.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate. Following Lipinski's Rule of Five, 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate?
The CAS number of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate is 460345-16-8.
What is the molecular formula of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate?
The molecular formula of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate is C11H19F3N2O3S.
What is the molecular weight of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate?
The molecular weight of 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate is 316.11 g/mol.
Where can I buy 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate?
You can request a quote for 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexyl-3-methylimidazolium Trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.