Nonafluoro-2,3-dihydro-1H-indene-5-thiol
TL;DR: Nonafluoro-2,3-dihydro-1H-indene-5-thiol (CAS 52267-66-0) is a chemical compound with molecular formula C9HF9S and molecular weight 311.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2,2,3,3,4,6,7-nonafluoroindene-5-thiol
Also Known As: Perfluoroindane-5-thiol, 5-MERCAPTOPERFLUOROINDAN, NONAFLUORO-2,3-DIHYDRO-1H-INDENE-5-THIOL, Indane-5-thiol, 1,1,2,2,3,3,4,6,7-nonafuoro-, 1,1,2,2,3,3,4,6,7-nonafluoroindene-5-thiol
| Molecular Formula | C9HF9S |
|---|---|
| Molecular Weight | 311.97 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 311.9655 |
| Heavy Atoms | 19 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 52267-66-0 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1F)F)S)F)C(C(C2(F)F)(F)F)(F)F |
| InChIKey | UTRCRAZVJFMIMJ-UHFFFAOYSA-N |
Product Overview
Nonafluoro-2,3-dihydro-1H-indene-5-thiol (CAS 52267-66-0), with molecular formula C9HF9S and molecular weight 311.97 g/mol. IUPAC: 1,1,2,2,3,3,4,6,7-nonafluoroindene-5-thiol.
Chemical Property Profile of Nonafluoro-2,3-dihydro-1H-indene-5-thiol
Property Insights of Nonafluoro-2,3-dihydro-1H-indene-5-thiol
The XLogP value of 3.7 indicates that Nonafluoro-2,3-dihydro-1H-indene-5-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, Nonafluoro-2,3-dihydro-1H-indene-5-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonafluoro-2,3-dihydro-1H-indene-5-thiol has 1 hydrogen bond donor(s) and 10 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 Nonafluoro-2,3-dihydro-1H-indene-5-thiol?
The CAS number of Nonafluoro-2,3-dihydro-1H-indene-5-thiol is 52267-66-0.
What is the molecular formula of Nonafluoro-2,3-dihydro-1H-indene-5-thiol?
The molecular formula of Nonafluoro-2,3-dihydro-1H-indene-5-thiol is C9HF9S.
What is the molecular weight of Nonafluoro-2,3-dihydro-1H-indene-5-thiol?
The molecular weight of Nonafluoro-2,3-dihydro-1H-indene-5-thiol is 311.97 g/mol.
Where can I buy Nonafluoro-2,3-dihydro-1H-indene-5-thiol?
You can request a quote for Nonafluoro-2,3-dihydro-1H-indene-5-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonafluoro-2,3-dihydro-1H-indene-5-thiol?
Yes, KEHONG BIO provides custom synthesis services for Nonafluoro-2,3-dihydro-1H-indene-5-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.