![[(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene structure](/static/products/6336/63369-94-8.webp)
[(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene
TL;DR: [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene (CAS 63369-94-8) is a chemical compound with molecular formula C12H5F9O2S and molecular weight 383.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)ethynylbenzene
Also Known As: [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene|2-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)ethynylbenzene
| Molecular Formula | C12H5F9O2S |
|---|---|
| Molecular Weight | 383.99 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.98666 |
| Heavy Atoms | 24 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 63369-94-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | GMVZRHHLZNLVLE-UHFFFAOYSA-N |
Product Overview
[(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene (CAS 63369-94-8), with molecular formula C12H5F9O2S and molecular weight 383.99 g/mol. IUPAC: 2-(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)ethynylbenzene.
Chemical Property Profile of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene
Property Insights of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene
The XLogP value of 5.0 indicates that [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene?
The CAS number of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene is 63369-94-8.
What is the molecular formula of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene?
The molecular formula of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene is C12H5F9O2S.
What is the molecular weight of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene?
The molecular weight of [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene is 383.99 g/mol.
Where can I buy [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene?
You can request a quote for [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for [(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)ethynyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.