Sodium p-octylphenolate
TL;DR: Sodium p-octylphenolate (CAS 78899-79-3) is a chemical compound with molecular formula C14H23NaO and molecular weight 230.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;hydride;4-octylphenol
Also Known As: Sodium p-octylphenolate, sodium,4-octylphenol, EINECS 279-001-5, sodium; hydride; 4-octylphenol
| Molecular Formula | C14H23NaO |
|---|---|
| Molecular Weight | 230.16 g/mol |
| LogP | 1.4117 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 230.16466 |
| Heavy Atoms | 16 |
| Complexity | 261.42966 |
Chemical Identifiers
| CAS Number | 78899-79-3 |
|---|---|
| SMILES | [H-].CCCCCCCCC1=CC=C(C=C1)O.[Na+] |
Product Overview
Sodium p-octylphenolate (CAS 78899-79-3), with molecular formula C14H23NaO and molecular weight 230.16 g/mol. IUPAC: sodium;hydride;4-octylphenol.
Chemical Property Profile of Sodium p-octylphenolate
Property Insights of Sodium p-octylphenolate
The XLogP value of 1.4117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sodium p-octylphenolate. With a topological polar surface area (TPSA) of 20.23 Ų, Sodium p-octylphenolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium p-octylphenolate has 1 hydrogen bond donor(s) and 1 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 Sodium p-octylphenolate?
The CAS number of Sodium p-octylphenolate is 78899-79-3.
What is the molecular formula of Sodium p-octylphenolate?
The molecular formula of Sodium p-octylphenolate is C14H23NaO.
What is the molecular weight of Sodium p-octylphenolate?
The molecular weight of Sodium p-octylphenolate is 230.16 g/mol.
Where can I buy Sodium p-octylphenolate?
You can request a quote for Sodium p-octylphenolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium p-octylphenolate?
Yes, KEHONG BIO provides custom synthesis services for Sodium p-octylphenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.