Phosphorodifluoridic acid, ethyl ester
TL;DR: Phosphorodifluoridic acid, ethyl ester (CAS 460-52-6) is a chemical compound with molecular formula C2H5F2O2P and molecular weight 130.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-difluorophosphoryloxyethane
Also Known As: Ethyl phosphorodifluoridate, ethyl difluoridophosphate, sNplLQxRPTaddeUMP@, ethyl difluorophosphate, Phosphorodifluoridic acid, ethyl ester
| Molecular Formula | C2H5F2O2P |
|---|---|
| Molecular Weight | 130.00 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 129.99953 |
| Heavy Atoms | 7 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 460-52-6 |
|---|---|
| SMILES | CCOP(=O)(F)F |
| InChIKey | CNDDYKSDJBKASR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphorodifluoridic acid, ethyl ester (CAS 460-52-6), with molecular formula C2H5F2O2P and molecular weight 130.00 g/mol. IUPAC: 1-difluorophosphoryloxyethane.
Chemical Property Profile of Phosphorodifluoridic acid, ethyl ester
Property Insights of Phosphorodifluoridic acid, ethyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorodifluoridic acid, ethyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Phosphorodifluoridic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorodifluoridic acid, ethyl 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 Phosphorodifluoridic acid, ethyl ester?
The CAS number of Phosphorodifluoridic acid, ethyl ester is 460-52-6.
What is the molecular formula of Phosphorodifluoridic acid, ethyl ester?
The molecular formula of Phosphorodifluoridic acid, ethyl ester is C2H5F2O2P.
What is the molecular weight of Phosphorodifluoridic acid, ethyl ester?
The molecular weight of Phosphorodifluoridic acid, ethyl ester is 130.00 g/mol.
Where can I buy Phosphorodifluoridic acid, ethyl ester?
You can request a quote for Phosphorodifluoridic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodifluoridic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodifluoridic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.