Benzenesulfonyl fluoride, 4-ethyl-
TL;DR: Benzenesulfonyl fluoride, 4-ethyl- (CAS 455-20-9) is a chemical compound with molecular formula C8H9FO2S and molecular weight 188.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylbenzenesulfonyl fluoride
Also Known As: 4-Ethylbenzenesulfonyl fluoride, p-Ethylbenzenesulphonyl fluoride, Benzenesulfonyl fluoride, 4-ethyl-, 4-ethylbenzene-1-sulfonyl fluoride, 4-ethyl-benzenesulfonyl fluoride
| Molecular Formula | C8H9FO2S |
|---|---|
| Molecular Weight | 188.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.03073 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 455-20-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)S(=O)(=O)F |
| InChIKey | YKTVOVMXBLLWNM-UHFFFAOYSA-N |
Product Overview
Benzenesulfonyl fluoride, 4-ethyl- (CAS 455-20-9), with molecular formula C8H9FO2S and molecular weight 188.03 g/mol. IUPAC: 4-ethylbenzenesulfonyl fluoride.
Chemical Property Profile of Benzenesulfonyl fluoride, 4-ethyl-
Property Insights of Benzenesulfonyl fluoride, 4-ethyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonyl fluoride, 4-ethyl-. With a topological polar surface area (TPSA) of 42.5 Ų, Benzenesulfonyl fluoride, 4-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenesulfonyl fluoride, 4-ethyl- has 0 hydrogen bond donor(s) and 3 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 Benzenesulfonyl fluoride, 4-ethyl-?
The CAS number of Benzenesulfonyl fluoride, 4-ethyl- is 455-20-9.
What is the molecular formula of Benzenesulfonyl fluoride, 4-ethyl-?
The molecular formula of Benzenesulfonyl fluoride, 4-ethyl- is C8H9FO2S.
What is the molecular weight of Benzenesulfonyl fluoride, 4-ethyl-?
The molecular weight of Benzenesulfonyl fluoride, 4-ethyl- is 188.03 g/mol.
Where can I buy Benzenesulfonyl fluoride, 4-ethyl-?
You can request a quote for Benzenesulfonyl fluoride, 4-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonyl fluoride, 4-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonyl fluoride, 4-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.