Phosphorofluoridothioic acid, O,O-diisopropyl ester
TL;DR: Phosphorofluoridothioic acid, O,O-diisopropyl ester (CAS 1000-22-2) is a chemical compound with molecular formula C6H14FO2PS and molecular weight 200.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
fluoro-di(propan-2-yloxy)-sulfanylidene-λ5-phosphane
Also Known As: Thiono-dfp, Phosphorofluoridothioic acid, O,O-diisopropyl ester, Phosphorofluoridothioic Acid O,O-Diisopropyl Ester, 4-01-00-01483 (Beilstein Handbook Reference), fluoro-di(propan-2-yloxy)-sulfanylidene-
| Molecular Formula | C6H14FO2PS |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.04361 |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 1000-22-2 |
|---|---|
| SMILES | CC(C)OP(=S)(OC(C)C)F |
| InChIKey | LLMZKGWACKHBEI-UHFFFAOYSA-N |
Product Overview
Phosphorofluoridothioic acid, O,O-diisopropyl ester (CAS 1000-22-2), with molecular formula C6H14FO2PS and molecular weight 200.04 g/mol. IUPAC: fluoro-di(propan-2-yloxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorofluoridothioic acid, O,O-diisopropyl ester
Property Insights of Phosphorofluoridothioic acid, O,O-diisopropyl ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorofluoridothioic acid, O,O-diisopropyl ester. With a topological polar surface area (TPSA) of 50.6 Ų, Phosphorofluoridothioic acid, O,O-diisopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorofluoridothioic acid, O,O-diisopropyl ester has 0 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 Phosphorofluoridothioic acid, O,O-diisopropyl ester?
The CAS number of Phosphorofluoridothioic acid, O,O-diisopropyl ester is 1000-22-2.
What is the molecular formula of Phosphorofluoridothioic acid, O,O-diisopropyl ester?
The molecular formula of Phosphorofluoridothioic acid, O,O-diisopropyl ester is C6H14FO2PS.
What is the molecular weight of Phosphorofluoridothioic acid, O,O-diisopropyl ester?
The molecular weight of Phosphorofluoridothioic acid, O,O-diisopropyl ester is 200.04 g/mol.
Where can I buy Phosphorofluoridothioic acid, O,O-diisopropyl ester?
You can request a quote for Phosphorofluoridothioic acid, O,O-diisopropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorofluoridothioic acid, O,O-diisopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorofluoridothioic acid, O,O-diisopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.