Hexyl ethylphosphonofluoridate
TL;DR: Hexyl ethylphosphonofluoridate (CAS 135445-19-1) is a chemical compound with molecular formula C8H18FO2P and molecular weight 196.10284 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[ethyl(fluoro)phosphoryl]oxyhexane
Also Known As: Hexyl ethylphosphonofluoridate, Hexyl ethylphosphonofluoridoate, 1-[ethyl(fluoro)phosphoryl]oxyhexane, Hexyl ethylphosphonofluoridoate #, Ethylphosphonofluoridic acid O-hexyl ester
Technical Specifications
| Molecular Formula | C8H18FO2P |
| Molecular Weight | 196.10284 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 196.10284 Da |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
| SMILES | CCCCCCOP(=O)(CC)F |
| InChIKey | ZYXRWBNFAGZKON-UHFFFAOYSA-N |
Chemical Property Profile of Hexyl ethylphosphonofluoridate
Property Insights of Hexyl ethylphosphonofluoridate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexyl ethylphosphonofluoridate. With a topological polar surface area (TPSA) of 26.3 Ų, Hexyl ethylphosphonofluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl ethylphosphonofluoridate 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
What is the CAS number of Hexyl ethylphosphonofluoridate?
The CAS number of Hexyl ethylphosphonofluoridate is 135445-19-1.
What is the molecular formula of Hexyl ethylphosphonofluoridate?
The molecular formula of Hexyl ethylphosphonofluoridate is C8H18FO2P.
What is the molecular weight of Hexyl ethylphosphonofluoridate?
The molecular weight of Hexyl ethylphosphonofluoridate is 196.10284 g/mol.
Where can I buy Hexyl ethylphosphonofluoridate?
You can request a quote for Hexyl ethylphosphonofluoridate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hexyl ethylphosphonofluoridate?
Yes, CoreyChem provides custom synthesis services for Hexyl ethylphosphonofluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.