甲基磺酰氟
TL;DR: 甲基磺酰氟 (CAS 558-25-8) is a chemical compound with molecular formula CH3FO2S and molecular weight 97.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基磺酰氟
methanesulfonyl fluoride
Also Known As: METHANESULFONYL FLUORIDE, Fumette, Mesyl fluoride, Fluoro methyl sulfone, fluoride
| Molecular Formula | CH3FO2S |
|---|---|
| Molecular Weight | 97.98 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 97.98378 |
| Heavy Atoms | 5 |
| Complexity | 95.0 |
| Boiling Point | 123.9 °C at 760 mmHg |
| Density | 1.368 g/cu cm at 20 °C |
| Solubility | In water, 3.00X10+4 mg/L at 20 °C |
| Vapor Pressure | 10.9 [mmHg] |
Chemical Identifiers
| CAS Number | 558-25-8 |
|---|---|
| SMILES | CS(=O)(=O)F |
| InChIKey | KNWQLFOXPQZGPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基磺酰氟 (CAS 558-25-8), with molecular formula CH3FO2S and molecular weight 97.98 g/mol. IUPAC: methanesulfonyl fluoride.
Chemical Property Profile of 甲基磺酰氟
Property Insights of 甲基磺酰氟
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基磺酰氟. With a topological polar surface area (TPSA) of 42.5 Ų, 甲基磺酰氟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基磺酰氟 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 甲基磺酰氟?
The CAS number of 甲基磺酰氟 is 558-25-8.
What is the molecular formula of 甲基磺酰氟?
The molecular formula of 甲基磺酰氟 is CH3FO2S.
What is the molecular weight of 甲基磺酰氟?
The molecular weight of 甲基磺酰氟 is 97.98 g/mol.
Where can I buy 甲基磺酰氟?
You can request a quote for 甲基磺酰氟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基磺酰氟?
Yes, KEHONG BIO provides custom synthesis services for 甲基磺酰氟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.