4-辛炔
TL;DR: 4-辛炔 (CAS 1942-45-6) 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.
4-辛炔
oct-4-yne
Also Known As: Oct-4-yne, Dipropylacetylene, 1,2-Dipropylacetylene, 3-dithylacetylene, Octane-4-yne
| 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 | 79.0 |
Chemical Identifiers
| CAS Number | 1942-45-6 |
|---|---|
| SMILES | CCCC#CCCC |
| InChIKey | GZTNBKQTTZSQNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-辛炔 (CAS 1942-45-6), with molecular formula C8H14 and molecular weight 110.11 g/mol. IUPAC: oct-4-yne.
Chemical Property Profile of 4-辛炔
Property Insights of 4-辛炔
The XLogP value of 3.4 indicates that 4-辛炔 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-辛炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-辛炔 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 4-辛炔?
The CAS number of 4-辛炔 is 1942-45-6.
What is the molecular formula of 4-辛炔?
The molecular formula of 4-辛炔 is C8H14.
What is the molecular weight of 4-辛炔?
The molecular weight of 4-辛炔 is 110.11 g/mol.
Where can I buy 4-辛炔?
You can request a quote for 4-辛炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-辛炔?
Yes, KEHONG BIO provides custom synthesis services for 4-辛炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.