Phenyl nonafluorobutane-1-sulfonate
TL;DR: Phenyl nonafluorobutane-1-sulfonate (CAS 25628-11-9) is a chemical compound with molecular formula C10H5F9O3S and molecular weight 375.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Also Known As: Phenyl-nonaflat, phenyl nonaflate, Phenyl nonafluorobutane-1-sulfonate, Perfluorobutanesulfonic acid, phenyl ester, Nonafluorobutane-1-sulfonic acid phenyl ester
| Molecular Formula | C10H5F9O3S |
|---|---|
| Molecular Weight | 375.98 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.98157 |
| Heavy Atoms | 23 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 25628-11-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | UXPCZDYRRUONAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenyl nonafluorobutane-1-sulfonate (CAS 25628-11-9), with molecular formula C10H5F9O3S and molecular weight 375.98 g/mol. IUPAC: phenyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate.
Chemical Property Profile of Phenyl nonafluorobutane-1-sulfonate
Property Insights of Phenyl nonafluorobutane-1-sulfonate
The XLogP value of 4.7 indicates that Phenyl nonafluorobutane-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, Phenyl nonafluorobutane-1-sulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl nonafluorobutane-1-sulfonate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenyl nonafluorobutane-1-sulfonate?
The CAS number of Phenyl nonafluorobutane-1-sulfonate is 25628-11-9.
What is the molecular formula of Phenyl nonafluorobutane-1-sulfonate?
The molecular formula of Phenyl nonafluorobutane-1-sulfonate is C10H5F9O3S.
What is the molecular weight of Phenyl nonafluorobutane-1-sulfonate?
The molecular weight of Phenyl nonafluorobutane-1-sulfonate is 375.98 g/mol.
Where can I buy Phenyl nonafluorobutane-1-sulfonate?
You can request a quote for Phenyl nonafluorobutane-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl nonafluorobutane-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl nonafluorobutane-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.