1,1-二氟甲磺酸
TL;DR: 1,1-二氟甲磺酸 (CAS 40856-07-3) is a chemical compound with molecular formula CH2F2O3S and molecular weight 131.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-二氟甲磺酸
difluoromethanesulfonic acid
Also Known As: Difluoromethanesulphonic acid, difluoromethanesulfonic acid, Difluormethansulfonsaeure, difluoromethane sulfonic acid, Difluoromethanesulphonicacid
| Molecular Formula | CH2F2O3S |
|---|---|
| Molecular Weight | 131.97 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.96927 |
| Heavy Atoms | 7 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 40856-07-3 |
|---|---|
| SMILES | C(F)(F)S(=O)(=O)O |
| InChIKey | CGDXUTMWWHKMOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-二氟甲磺酸 (CAS 40856-07-3), with molecular formula CH2F2O3S and molecular weight 131.97 g/mol. IUPAC: difluoromethanesulfonic acid.
Chemical Property Profile of 1,1-二氟甲磺酸
Property Insights of 1,1-二氟甲磺酸
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-二氟甲磺酸. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-二氟甲磺酸. Following Lipinski's Rule of Five, 1,1-二氟甲磺酸 has 1 hydrogen bond donor(s) and 5 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 1,1-二氟甲磺酸?
The CAS number of 1,1-二氟甲磺酸 is 40856-07-3.
What is the molecular formula of 1,1-二氟甲磺酸?
The molecular formula of 1,1-二氟甲磺酸 is CH2F2O3S.
What is the molecular weight of 1,1-二氟甲磺酸?
The molecular weight of 1,1-二氟甲磺酸 is 131.97 g/mol.
Where can I buy 1,1-二氟甲磺酸?
You can request a quote for 1,1-二氟甲磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-二氟甲磺酸?
Yes, KEHONG BIO provides custom synthesis services for 1,1-二氟甲磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.