9,10-dihydro-9,10-ethenoanthracen-11-yl triflate
TL;DR: 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate (CAS 91759-14-7) is a chemical compound with molecular formula C17H11F3O3S and molecular weight 352.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaenyl trifluoromethanesulfonate
Also Known As: 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate, 9,10-Dihydro-9,10-ethenoanthracen-11-yl trifluoromethanesulfonate, 15-Tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaenyl trifluoromethanesulfonate
| Molecular Formula | C17H11F3O3S |
|---|---|
| Molecular Weight | 352.04 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.0381 |
| Heavy Atoms | 24 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 91759-14-7 |
|---|---|
| SMILES | C1=CC=C2C3C4=CC=CC=C4C(C2=C1)C=C3OS(=O)(=O)C(F)(F)F |
| InChIKey | IFLQYUWVKUMLBX-UHFFFAOYSA-N |
Product Overview
9,10-dihydro-9,10-ethenoanthracen-11-yl triflate (CAS 91759-14-7), with molecular formula C17H11F3O3S and molecular weight 352.04 g/mol. IUPAC: 15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaenyl trifluoromethanesulfonate.
Chemical Property Profile of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate
Property Insights of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate
The XLogP value of 4.5 indicates that 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate 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 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate?
The CAS number of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate is 91759-14-7.
What is the molecular formula of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate?
The molecular formula of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate is C17H11F3O3S.
What is the molecular weight of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate?
The molecular weight of 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate is 352.04 g/mol.
Where can I buy 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate?
You can request a quote for 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate?
Yes, KEHONG BIO provides custom synthesis services for 9,10-dihydro-9,10-ethenoanthracen-11-yl triflate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.