1-Dibutylphosphoryloxy-2-fluorobenzene
TL;DR: 1-Dibutylphosphoryloxy-2-fluorobenzene (CAS 7526-45-6) is a chemical compound with molecular formula C14H22FO2P and molecular weight 272.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dibutylphosphoryloxy-2-fluorobenzene
Also Known As: 1-dibutylphosphoryloxy-2-fluorobenzene, 2-Fluorophenyl dibutylphosphinate
| Molecular Formula | C14H22FO2P |
|---|---|
| Molecular Weight | 272.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 272.13416 |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 7526-45-6 |
|---|---|
| SMILES | CCCCP(=O)(CCCC)OC1=CC=CC=C1F |
| InChIKey | LGNOTTGIPIRYSF-UHFFFAOYSA-N |
Product Overview
1-Dibutylphosphoryloxy-2-fluorobenzene (CAS 7526-45-6), with molecular formula C14H22FO2P and molecular weight 272.13 g/mol. IUPAC: 1-dibutylphosphoryloxy-2-fluorobenzene.
Chemical Property Profile of 1-Dibutylphosphoryloxy-2-fluorobenzene
Property Insights of 1-Dibutylphosphoryloxy-2-fluorobenzene
The XLogP value of 3.8 indicates that 1-Dibutylphosphoryloxy-2-fluorobenzene 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-Dibutylphosphoryloxy-2-fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Dibutylphosphoryloxy-2-fluorobenzene 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 1-Dibutylphosphoryloxy-2-fluorobenzene?
The CAS number of 1-Dibutylphosphoryloxy-2-fluorobenzene is 7526-45-6.
What is the molecular formula of 1-Dibutylphosphoryloxy-2-fluorobenzene?
The molecular formula of 1-Dibutylphosphoryloxy-2-fluorobenzene is C14H22FO2P.
What is the molecular weight of 1-Dibutylphosphoryloxy-2-fluorobenzene?
The molecular weight of 1-Dibutylphosphoryloxy-2-fluorobenzene is 272.13 g/mol.
Where can I buy 1-Dibutylphosphoryloxy-2-fluorobenzene?
You can request a quote for 1-Dibutylphosphoryloxy-2-fluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Dibutylphosphoryloxy-2-fluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Dibutylphosphoryloxy-2-fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.