Pentyl methylphosphonofluoridate
TL;DR: Pentyl methylphosphonofluoridate (CAS 13454-59-6) is a chemical compound with molecular formula C6H14FO2P and molecular weight 168.07155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[fluoro(methyl)phosphoryl]oxypentane
Also Known As: Pentyl methylphosphonofluoridate, n-Pentyl methylphosphonofluoridate, Pentyl methylphosphonofluoridoate #, 1-[fluoro(methyl)phosphoryl]oxypentane, Methylphosphonofluoridic acid O-pentyl ester
Technical Specifications
| Molecular Formula | C6H14FO2P |
| Molecular Weight | 168.07155 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.07155 Da |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
| SMILES | CCCCCOP(=O)(C)F |
| InChIKey | DCTCNMMFVAJVCF-UHFFFAOYSA-N |
Chemical Property Profile of Pentyl methylphosphonofluoridate
Property Insights of Pentyl methylphosphonofluoridate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentyl methylphosphonofluoridate. With a topological polar surface area (TPSA) of 26.3 Ų, Pentyl methylphosphonofluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl methylphosphonofluoridate 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 Pentyl methylphosphonofluoridate?
The CAS number of Pentyl methylphosphonofluoridate is 13454-59-6.
What is the molecular formula of Pentyl methylphosphonofluoridate?
The molecular formula of Pentyl methylphosphonofluoridate is C6H14FO2P.
What is the molecular weight of Pentyl methylphosphonofluoridate?
The molecular weight of Pentyl methylphosphonofluoridate is 168.07155 g/mol.
Where can I buy Pentyl methylphosphonofluoridate?
You can request a quote for Pentyl methylphosphonofluoridate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pentyl methylphosphonofluoridate?
Yes, CoreyChem provides custom synthesis services for Pentyl methylphosphonofluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.