4-壬基苯酚
TL;DR: 4-壬基苯酚 (CAS 104-40-5) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-壬基苯酚
4-nonylphenol
Also Known As: 4-nonylphenol, 4-n-Nonylphenol, p-Nonylphenol, 4-nonyl phenol, para-Nonylphenol
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 148.0 |
| Melting Point | 42 °C |
| Boiling Point | 317 °C |
| Density | 0.950 g/cu cm at 20 °C |
| Solubility | In water, 7 mg/L at 25 °C |
| Flash Point | 113 °C (112.8 °C) - closed cup |
| Vapor Pressure | 0.000818 [mmHg] |
| Refractive Index | 1.513 at 20 °C |
Chemical Identifiers
| CAS Number | 104-40-5 |
|---|---|
| SMILES | CCCCCCCCCC1=CC=C(C=C1)O |
| InChIKey | IGFHQQFPSIBGKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-壬基苯酚 (CAS 104-40-5), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: 4-nonylphenol.
Chemical Property Profile of 4-壬基苯酚
Property Insights of 4-壬基苯酚
The XLogP value of 5.9 indicates that 4-壬基苯酚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-壬基苯酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-壬基苯酚 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-壬基苯酚?
The CAS number of 4-壬基苯酚 is 104-40-5.
What is the molecular formula of 4-壬基苯酚?
The molecular formula of 4-壬基苯酚 is C15H24O.
What is the molecular weight of 4-壬基苯酚?
The molecular weight of 4-壬基苯酚 is 220.18 g/mol.
Where can I buy 4-壬基苯酚?
You can request a quote for 4-壬基苯酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-壬基苯酚?
Yes, KEHONG BIO provides custom synthesis services for 4-壬基苯酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.