Diisopropyl difluoromethylphosphonate
TL;DR: Diisopropyl difluoromethylphosphonate (CAS 681-80-1) is a chemical compound with molecular formula C7H15F2O3P and molecular weight 216.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[difluoromethyl(propan-2-yloxy)phosphoryl]oxypropane
Also Known As: diisopropyl difluoromethylphosphonate, LHZZAGSFNNHJKI-UHFFFAOYSA-, 2-[difluoromethyl(propan-2-yloxy)phosphoryl]oxypropane, DIISOPROPYLDIFLUOROMETHYLPHOSPHONATE, bis(propan-2-yl) (difluoromethyl)phosphonate
| Molecular Formula | C7H15F2O3P |
|---|---|
| Molecular Weight | 216.07 g/mol |
| LogP | 3.2521 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 216.0727 |
| Heavy Atoms | 13 |
| Complexity | 180.17668 |
Chemical Identifiers
| CAS Number | 681-80-1 |
|---|---|
| SMILES | CC(C)OP(=O)(C(F)F)OC(C)C |
Product Overview
Diisopropyl difluoromethylphosphonate (CAS 681-80-1), with molecular formula C7H15F2O3P and molecular weight 216.07 g/mol. IUPAC: 2-[difluoromethyl(propan-2-yloxy)phosphoryl]oxypropane.
Chemical Property Profile of Diisopropyl difluoromethylphosphonate
Property Insights of Diisopropyl difluoromethylphosphonate
The XLogP value of 3.2521 indicates that Diisopropyl difluoromethylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Diisopropyl difluoromethylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diisopropyl difluoromethylphosphonate 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 Diisopropyl difluoromethylphosphonate?
The CAS number of Diisopropyl difluoromethylphosphonate is 681-80-1.
What is the molecular formula of Diisopropyl difluoromethylphosphonate?
The molecular formula of Diisopropyl difluoromethylphosphonate is C7H15F2O3P.
What is the molecular weight of Diisopropyl difluoromethylphosphonate?
The molecular weight of Diisopropyl difluoromethylphosphonate is 216.07 g/mol.
Where can I buy Diisopropyl difluoromethylphosphonate?
You can request a quote for Diisopropyl difluoromethylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diisopropyl difluoromethylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diisopropyl difluoromethylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.