Cyclohexylidenemethyl trifluoromethanesulfonate
TL;DR: Cyclohexylidenemethyl trifluoromethanesulfonate (CAS 53282-32-9) is a chemical compound with molecular formula C8H11F3O3S and molecular weight 244.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexylidenemethyl trifluoromethanesulfonate
Also Known As: Cyclohexylidenemethyl trifluoromethanesulfonate, cyclohexylidenyl triflate, cyclohexylidenemethyl triflate, trifluoromethylsulfonyloxymethylidenecyclohexane, Cyclohexylidenemethyl 1,1,1-trifluoromethanesulfonate
| Molecular Formula | C8H11F3O3S |
|---|---|
| Molecular Weight | 244.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.0381 |
| Heavy Atoms | 15 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 53282-32-9 |
|---|---|
| SMILES | C1CCC(=COS(=O)(=O)C(F)(F)F)CC1 |
| InChIKey | GCBOFZACDIPPCH-UHFFFAOYSA-N |
Product Overview
Cyclohexylidenemethyl trifluoromethanesulfonate (CAS 53282-32-9), with molecular formula C8H11F3O3S and molecular weight 244.04 g/mol. IUPAC: cyclohexylidenemethyl trifluoromethanesulfonate.
Chemical Property Profile of Cyclohexylidenemethyl trifluoromethanesulfonate
Property Insights of Cyclohexylidenemethyl trifluoromethanesulfonate
The XLogP value of 3.0 indicates that Cyclohexylidenemethyl trifluoromethanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, Cyclohexylidenemethyl trifluoromethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexylidenemethyl trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 6 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 Cyclohexylidenemethyl trifluoromethanesulfonate?
The CAS number of Cyclohexylidenemethyl trifluoromethanesulfonate is 53282-32-9.
What is the molecular formula of Cyclohexylidenemethyl trifluoromethanesulfonate?
The molecular formula of Cyclohexylidenemethyl trifluoromethanesulfonate is C8H11F3O3S.
What is the molecular weight of Cyclohexylidenemethyl trifluoromethanesulfonate?
The molecular weight of Cyclohexylidenemethyl trifluoromethanesulfonate is 244.04 g/mol.
Where can I buy Cyclohexylidenemethyl trifluoromethanesulfonate?
You can request a quote for Cyclohexylidenemethyl trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexylidenemethyl trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexylidenemethyl trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.