4-Octanol
TL;DR: 4-Octanol (CAS 589-62-8) is a chemical compound with molecular formula C8H18O and molecular weight 130.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octan-4-ol
Also Known As: Octan-4-ol, n-Octan-4-ol, Butylpropylcarbinol, 4-Octyl Alcohol, 4-hydroxyoctane
| Molecular Formula | C8H18O |
|---|---|
| Molecular Weight | 130.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 130.13577 |
| Heavy Atoms | 9 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 589-62-8 |
|---|---|
| SMILES | CCCCC(CCC)O |
| InChIKey | WOFPPJOZXUTRAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Octanol (CAS 589-62-8), with molecular formula C8H18O and molecular weight 130.14 g/mol. IUPAC: octan-4-ol.
Chemical Property Profile of 4-Octanol
Property Insights of 4-Octanol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Octanol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Octanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Octanol 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 4-Octanol?
The CAS number of 4-Octanol is 589-62-8.
What is the molecular formula of 4-Octanol?
The molecular formula of 4-Octanol is C8H18O.
What is the molecular weight of 4-Octanol?
The molecular weight of 4-Octanol is 130.14 g/mol.
Where can I buy 4-Octanol?
You can request a quote for 4-Octanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Octanol?
Yes, KEHONG BIO provides custom synthesis services for 4-Octanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.