3-Octanol, 6-ethyl-
TL;DR: 3-Octanol, 6-ethyl- (CAS 19781-27-2) is a chemical compound with molecular formula C10H22O and molecular weight 158.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyloctan-3-ol
Also Known As: 6-Ethyl-3-octanol, 6-ethyloctan-3-ol, 3-Octanol, 6-ethyl-, 6-Ethyl-Octan-3-Ol, ETHYL-3-ETHYLPENTYLCARBINOL
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 19781-27-2 |
|---|---|
| SMILES | CCC(CC)CCC(CC)O |
| InChIKey | JWZFCOOWAQHCBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Octanol, 6-ethyl- (CAS 19781-27-2), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 6-ethyloctan-3-ol.
Chemical Property Profile of 3-Octanol, 6-ethyl-
Property Insights of 3-Octanol, 6-ethyl-
The XLogP value of 3.6 indicates that 3-Octanol, 6-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Octanol, 6-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Octanol, 6-ethyl- 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 3-Octanol, 6-ethyl-?
The CAS number of 3-Octanol, 6-ethyl- is 19781-27-2.
What is the molecular formula of 3-Octanol, 6-ethyl-?
The molecular formula of 3-Octanol, 6-ethyl- is C10H22O.
What is the molecular weight of 3-Octanol, 6-ethyl-?
The molecular weight of 3-Octanol, 6-ethyl- is 158.17 g/mol.
Where can I buy 3-Octanol, 6-ethyl-?
You can request a quote for 3-Octanol, 6-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Octanol, 6-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Octanol, 6-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.