octane
TL;DR: octane (CAS 66813-84-1) is a chemical compound with molecular formula C8H17 and molecular weight 113.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: octane, octyl, Octil, Octyl radical
| Molecular Formula | C8H17 |
|---|---|
| Molecular Weight | 113.13 g/mol |
| LogP | 3.18099 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 113.133026 |
| Heavy Atoms | 8 |
| Complexity | 25.01955 |
Chemical Identifiers
| CAS Number | 66813-84-1 |
|---|---|
| SMILES | CCCCCCC[CH2] |
Product Overview
octane (CAS 66813-84-1), with molecular formula C8H17 and molecular weight 113.13 g/mol.
Chemical Property Profile of octane
Property Insights of octane
The XLogP value of 3.18099 indicates that octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, octane has 0 hydrogen bond donor(s) and 0 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 octane?
The CAS number of octane is 66813-84-1.
What is the molecular formula of octane?
The molecular formula of octane is C8H17.
What is the molecular weight of octane?
The molecular weight of octane is 113.13 g/mol.
Where can I buy octane?
You can request a quote for octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for octane?
Yes, KEHONG BIO provides custom synthesis services for octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.