4-Hydroxy-3-methylbenzenesulfonyl fluoride
TL;DR: 4-Hydroxy-3-methylbenzenesulfonyl fluoride (CAS 328-85-8) is a chemical compound with molecular formula C7H7FO3S and molecular weight 190.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-methylbenzenesulfonyl fluoride
Also Known As: 4-hydroxy-3-methylbenzenesulfonyl fluoride, 6-hydroxy-toluene-3-sulfonyl fluoride, Benzenesulfonyl fluoride, 4-hydroxy-3-methyl-, 4-Hydroxy-3-methylbenzene-1-sulfonyl fluoride
| Molecular Formula | C7H7FO3S |
|---|---|
| Molecular Weight | 190.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.01 |
| Heavy Atoms | 12 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 328-85-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)F)O |
| InChIKey | VWUZZTFOOGDELL-UHFFFAOYSA-N |
Product Overview
4-Hydroxy-3-methylbenzenesulfonyl fluoride (CAS 328-85-8), with molecular formula C7H7FO3S and molecular weight 190.01 g/mol. IUPAC: 4-hydroxy-3-methylbenzenesulfonyl fluoride.
Chemical Property Profile of 4-Hydroxy-3-methylbenzenesulfonyl fluoride
Property Insights of 4-Hydroxy-3-methylbenzenesulfonyl fluoride
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3-methylbenzenesulfonyl fluoride. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-3-methylbenzenesulfonyl fluoride. Following Lipinski's Rule of Five, 4-Hydroxy-3-methylbenzenesulfonyl fluoride has 1 hydrogen bond donor(s) and 4 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-Hydroxy-3-methylbenzenesulfonyl fluoride?
The CAS number of 4-Hydroxy-3-methylbenzenesulfonyl fluoride is 328-85-8.
What is the molecular formula of 4-Hydroxy-3-methylbenzenesulfonyl fluoride?
The molecular formula of 4-Hydroxy-3-methylbenzenesulfonyl fluoride is C7H7FO3S.
What is the molecular weight of 4-Hydroxy-3-methylbenzenesulfonyl fluoride?
The molecular weight of 4-Hydroxy-3-methylbenzenesulfonyl fluoride is 190.01 g/mol.
Where can I buy 4-Hydroxy-3-methylbenzenesulfonyl fluoride?
You can request a quote for 4-Hydroxy-3-methylbenzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3-methylbenzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3-methylbenzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.