1-Ethylhexyl propylphosphonofluoridoate
TL;DR: 1-Ethylhexyl propylphosphonofluoridoate (CAS 56922-79-3) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-hex-2-enyl] hexanoate
Also Known As: -hex-2-enylhexanoate, (Z)-Hex-2-enyl hexanoate, (Z)-2-Hexenyl hexanoate, (3z)-hexenyl hexanoate, [(Z)-hex-2-enyl] hexanoate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.4662 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 161.70467 |
Chemical Identifiers
| CAS Number | 56922-79-3 |
|---|---|
| SMILES | CCCCCC(=O)OC/C=C\CCC |
Product Overview
1-Ethylhexyl propylphosphonofluoridoate (CAS 56922-79-3), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: [(Z)-hex-2-enyl] hexanoate.
Chemical Property Profile of 1-Ethylhexyl propylphosphonofluoridoate
Property Insights of 1-Ethylhexyl propylphosphonofluoridoate
The XLogP value of 3.4662 indicates that 1-Ethylhexyl propylphosphonofluoridoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Ethylhexyl propylphosphonofluoridoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylhexyl propylphosphonofluoridoate has 0 hydrogen bond donor(s) and 2 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 1-Ethylhexyl propylphosphonofluoridoate?
The CAS number of 1-Ethylhexyl propylphosphonofluoridoate is 56922-79-3.
What is the molecular formula of 1-Ethylhexyl propylphosphonofluoridoate?
The molecular formula of 1-Ethylhexyl propylphosphonofluoridoate is C12H22O2.
What is the molecular weight of 1-Ethylhexyl propylphosphonofluoridoate?
The molecular weight of 1-Ethylhexyl propylphosphonofluoridoate is 198.16 g/mol.
Where can I buy 1-Ethylhexyl propylphosphonofluoridoate?
You can request a quote for 1-Ethylhexyl propylphosphonofluoridoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylhexyl propylphosphonofluoridoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylhexyl propylphosphonofluoridoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.