![4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- structure](/static/products/1024/102489-65-6.webp)
4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-
TL;DR: 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- (CAS 102489-65-6) is a chemical compound with molecular formula C9H10F4S and molecular weight 226.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,5,5-tetrafluoro-3-thiatricyclo[5.2.1.02,6]decane
Also Known As: tetrafluoro[?], 2,2,3,3-Tetrafluorohexahydro-4,7-methanobenzothiophene, 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-
| Molecular Formula | C9H10F4S |
|---|---|
| Molecular Weight | 226.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.04393 |
| Heavy Atoms | 14 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 102489-65-6 |
|---|---|
| SMILES | C1CC2CC1C3C2SC(C3(F)F)(F)F |
| InChIKey | YLAQRRWKEQXQAE-UHFFFAOYSA-N |
Product Overview
4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- (CAS 102489-65-6), with molecular formula C9H10F4S and molecular weight 226.04 g/mol. IUPAC: 4,4,5,5-tetrafluoro-3-thiatricyclo[5.2.1.02,6]decane.
Chemical Property Profile of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-
Property Insights of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-
The XLogP value of 3.7 indicates that 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- has 0 hydrogen bond donor(s) and 5 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 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-?
The CAS number of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- is 102489-65-6.
What is the molecular formula of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-?
The molecular formula of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- is C9H10F4S.
What is the molecular weight of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-?
The molecular weight of 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- is 226.04 g/mol.
Where can I buy 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-?
You can request a quote for 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro-?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Methanobenzo[b]thiophene, 2,2,3,3-tetrafluorooctahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.