Oct-3-yne
TL;DR: Oct-3-yne (CAS 15232-76-5) is a chemical compound with molecular formula C8H14 and molecular weight 110.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oct-3-yne
Also Known As: 3-Octyne, Oct-3-yne, Butylethylacetylene, Ethylbutylacetylene, 1-Ethyl-2-butylacetylene
| Molecular Formula | C8H14 |
|---|---|
| Molecular Weight | 110.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.10955 |
| Heavy Atoms | 8 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 15232-76-5 |
|---|---|
| SMILES | CCCCC#CCC |
| InChIKey | UDEISTCPVNLKRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oct-3-yne (CAS 15232-76-5), with molecular formula C8H14 and molecular weight 110.11 g/mol. IUPAC: oct-3-yne.
Chemical Property Profile of Oct-3-yne
Property Insights of Oct-3-yne
The XLogP value of 3.4 indicates that Oct-3-yne is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Oct-3-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oct-3-yne 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 Oct-3-yne?
The CAS number of Oct-3-yne is 15232-76-5.
What is the molecular formula of Oct-3-yne?
The molecular formula of Oct-3-yne is C8H14.
What is the molecular weight of Oct-3-yne?
The molecular weight of Oct-3-yne is 110.11 g/mol.
Where can I buy Oct-3-yne?
You can request a quote for Oct-3-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oct-3-yne?
Yes, KEHONG BIO provides custom synthesis services for Oct-3-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.