1-Hexadecyl-3-methylimidazolium Chloride
TL;DR: 1-Hexadecyl-3-methylimidazolium Chloride (CAS 61546-01-8) is a chemical compound with molecular formula C20H39ClN2 and molecular weight 342.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexadecyl-3-methylimidazol-3-ium chloride
Also Known As: 1-HEXADECYL-3-METHYLIMIDAZOLIUM CHLORIDE, 3-hexadecyl-1-methyl-1H-imidazol-3-ium chloride, Tox21_200600, 1-Cetyl-3-methylimidazolium chloride, 1-hexadecyl-3-methylimidazol-3-ium;chloride
| Molecular Formula | C20H39ClN2 |
|---|---|
| Molecular Weight | 342.28 g/mol |
| LogP | 2.7979 |
| Topological Polar Surface Area | 8.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 15 |
| Exact Mass | 342.28018 |
| Heavy Atoms | 23 |
| Complexity | 349.1658 |
Chemical Identifiers
| CAS Number | 61546-01-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-] |
Product Overview
1-Hexadecyl-3-methylimidazolium Chloride (CAS 61546-01-8), with molecular formula C20H39ClN2 and molecular weight 342.28 g/mol. IUPAC: 1-hexadecyl-3-methylimidazol-3-ium chloride.
Chemical Property Profile of 1-Hexadecyl-3-methylimidazolium Chloride
Property Insights of 1-Hexadecyl-3-methylimidazolium Chloride
The XLogP value of 2.7979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hexadecyl-3-methylimidazolium Chloride. With a topological polar surface area (TPSA) of 8.81 Ų, 1-Hexadecyl-3-methylimidazolium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hexadecyl-3-methylimidazolium Chloride has 0 hydrogen bond donor(s) and 0 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-Hexadecyl-3-methylimidazolium Chloride?
The CAS number of 1-Hexadecyl-3-methylimidazolium Chloride is 61546-01-8.
What is the molecular formula of 1-Hexadecyl-3-methylimidazolium Chloride?
The molecular formula of 1-Hexadecyl-3-methylimidazolium Chloride is C20H39ClN2.
What is the molecular weight of 1-Hexadecyl-3-methylimidazolium Chloride?
The molecular weight of 1-Hexadecyl-3-methylimidazolium Chloride is 342.28 g/mol.
Where can I buy 1-Hexadecyl-3-methylimidazolium Chloride?
You can request a quote for 1-Hexadecyl-3-methylimidazolium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexadecyl-3-methylimidazolium Chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexadecyl-3-methylimidazolium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.