Isopropyl propylphosphonofluoridoate
TL;DR: Isopropyl propylphosphonofluoridoate (CAS 18358-37-7) is a chemical compound with molecular formula C6H14FO2P and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[fluoro(propan-2-yloxy)phosphoryl]propane
Also Known As: ethyl sarin, Isopropyl propylphosphonofluoridoate, propan-2-yl propylphosphonofluoridate, Isopropyl propylphosphonofluoridoate #, 1-Methylethyl P-propylphosphonofluoridate
| Molecular Formula | C6H14FO2P |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.07155 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 18358-37-7 |
|---|---|
| SMILES | CCCP(=O)(OC(C)C)F |
| InChIKey | FETXTCAOLPVKEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropyl propylphosphonofluoridoate (CAS 18358-37-7), with molecular formula C6H14FO2P and molecular weight 168.07 g/mol. IUPAC: 1-[fluoro(propan-2-yloxy)phosphoryl]propane.
Chemical Property Profile of Isopropyl propylphosphonofluoridoate
Property Insights of Isopropyl propylphosphonofluoridoate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl propylphosphonofluoridoate. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl propylphosphonofluoridoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl propylphosphonofluoridoate 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 Isopropyl propylphosphonofluoridoate?
The CAS number of Isopropyl propylphosphonofluoridoate is 18358-37-7.
What is the molecular formula of Isopropyl propylphosphonofluoridoate?
The molecular formula of Isopropyl propylphosphonofluoridoate is C6H14FO2P.
What is the molecular weight of Isopropyl propylphosphonofluoridoate?
The molecular weight of Isopropyl propylphosphonofluoridoate is 168.07 g/mol.
Where can I buy Isopropyl propylphosphonofluoridoate?
You can request a quote for Isopropyl propylphosphonofluoridoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl propylphosphonofluoridoate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl propylphosphonofluoridoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.