1,1-二氯-1-氟甲磺酰氯
TL;DR: 1,1-二氯-1-氟甲磺酰氯 (CAS 2712-93-8) is a chemical compound with molecular formula CCl3FS and molecular weight 167.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-二氯-1-氟甲磺酰氯
[dichloro(fluoro)methyl] thiohypochlorite
Also Known As: Dichlorofluoromethanesulfenyl chloride, Cl2FCSCl, CCl3FS, C-Cl3-F-S, Methanesulfenyl chloride, dichlorofluoro-
| Molecular Formula | CCl3FS |
|---|---|
| Molecular Weight | 167.88 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.87703 |
| Heavy Atoms | 6 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 2712-93-8 |
|---|---|
| SMILES | C(F)(SCl)(Cl)Cl |
| InChIKey | KDRSHFSCTSFYGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-二氯-1-氟甲磺酰氯 (CAS 2712-93-8), with molecular formula CCl3FS and molecular weight 167.88 g/mol. IUPAC: [dichloro(fluoro)methyl] thiohypochlorite.
Chemical Property Profile of 1,1-二氯-1-氟甲磺酰氯
Property Insights of 1,1-二氯-1-氟甲磺酰氯
The XLogP value of 3.0 indicates that 1,1-二氯-1-氟甲磺酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 1,1-二氯-1-氟甲磺酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-二氯-1-氟甲磺酰氯 has 0 hydrogen bond donor(s) and 2 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 1,1-二氯-1-氟甲磺酰氯?
The CAS number of 1,1-二氯-1-氟甲磺酰氯 is 2712-93-8.
What is the molecular formula of 1,1-二氯-1-氟甲磺酰氯?
The molecular formula of 1,1-二氯-1-氟甲磺酰氯 is CCl3FS.
What is the molecular weight of 1,1-二氯-1-氟甲磺酰氯?
The molecular weight of 1,1-二氯-1-氟甲磺酰氯 is 167.88 g/mol.
Where can I buy 1,1-二氯-1-氟甲磺酰氯?
You can request a quote for 1,1-二氯-1-氟甲磺酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-二氯-1-氟甲磺酰氯?
Yes, KEHONG BIO provides custom synthesis services for 1,1-二氯-1-氟甲磺酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.