Octan-2-ol;octan-2-one
TL;DR: Octan-2-ol;octan-2-one (CAS 6646-70-4) is a chemical compound with molecular formula C16H34O2 and molecular weight 258.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octan-2-ol;octan-2-one
Also Known As: Octan-2-one, Octan-2-ol, 2-chloro-1-aza-azulene, Octan-2-ol;octan-2-one, octan-2-ol; octan-2-one
| Molecular Formula | C16H34O2 |
|---|---|
| Molecular Weight | 258.26 g/mol |
| LogP | 4.8834 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 258.2559 |
| Heavy Atoms | 18 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 6646-70-4 |
|---|---|
| SMILES | CCCCCCC(C)O.CCCCCCC(=O)C |
| InChIKey | OVLLYKKSSIIUMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octan-2-ol;octan-2-one (CAS 6646-70-4), with molecular formula C16H34O2 and molecular weight 258.26 g/mol. IUPAC: octan-2-ol;octan-2-one.
Chemical Property Profile of Octan-2-ol;octan-2-one
Property Insights of Octan-2-ol;octan-2-one
The XLogP value of 4.8834 indicates that Octan-2-ol;octan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Octan-2-ol;octan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octan-2-ol;octan-2-one has 1 hydrogen bond donor(s) and 2 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 Octan-2-ol;octan-2-one?
The CAS number of Octan-2-ol;octan-2-one is 6646-70-4.
What is the molecular formula of Octan-2-ol;octan-2-one?
The molecular formula of Octan-2-ol;octan-2-one is C16H34O2.
What is the molecular weight of Octan-2-ol;octan-2-one?
The molecular weight of Octan-2-ol;octan-2-one is 258.26 g/mol.
Where can I buy Octan-2-ol;octan-2-one?
You can request a quote for Octan-2-ol;octan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octan-2-ol;octan-2-one?
Yes, KEHONG BIO provides custom synthesis services for Octan-2-ol;octan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.