2-Hexylphenol
TL;DR: 2-Hexylphenol (CAS 3226-32-2) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexylphenol
Also Known As: 2-Hexylphenol, o-Hexylphenol, Phenol, 2-hexyl-, hexylphenol, 2-n-Hexylphenol
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 3226-32-2 |
|---|---|
| SMILES | CCCCCCC1=CC=CC=C1O |
| InChIKey | ABMULKFGWTYIIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hexylphenol (CAS 3226-32-2), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: 2-hexylphenol.
Chemical Property Profile of 2-Hexylphenol
Property Insights of 2-Hexylphenol
The XLogP value of 4.6 indicates that 2-Hexylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Hexylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexylphenol 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 2-Hexylphenol?
The CAS number of 2-Hexylphenol is 3226-32-2.
What is the molecular formula of 2-Hexylphenol?
The molecular formula of 2-Hexylphenol is C12H18O.
What is the molecular weight of 2-Hexylphenol?
The molecular weight of 2-Hexylphenol is 178.14 g/mol.
Where can I buy 2-Hexylphenol?
You can request a quote for 2-Hexylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.