Oct-5-en-1-yne
TL;DR: Oct-5-en-1-yne (CAS 2229669-70-7) is a chemical compound with molecular formula C8H12 and molecular weight 108.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-oct-5-en-1-yne
Also Known As: oct-5-en-1-yne, (E)-oct-5-en-1-yne, EINECS 255-304-8
| Molecular Formula | C8H12 |
|---|---|
| Molecular Weight | 108.09 g/mol |
| LogP | 2.366 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 108.0939 |
| Heavy Atoms | 8 |
| Complexity | 93.09616 |
Chemical Identifiers
| CAS Number | 2229669-70-7 |
|---|---|
| SMILES | CC/C=C/CCC#C |
Product Overview
Oct-5-en-1-yne (CAS 2229669-70-7), with molecular formula C8H12 and molecular weight 108.09 g/mol. IUPAC: (E)-oct-5-en-1-yne.
Chemical Property Profile of Oct-5-en-1-yne
Property Insights of Oct-5-en-1-yne
The XLogP value of 2.366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oct-5-en-1-yne. With a topological polar surface area (TPSA) of 0.0 Ų, Oct-5-en-1-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oct-5-en-1-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-5-en-1-yne?
The CAS number of Oct-5-en-1-yne is 2229669-70-7.
What is the molecular formula of Oct-5-en-1-yne?
The molecular formula of Oct-5-en-1-yne is C8H12.
What is the molecular weight of Oct-5-en-1-yne?
The molecular weight of Oct-5-en-1-yne is 108.09 g/mol.
Where can I buy Oct-5-en-1-yne?
You can request a quote for Oct-5-en-1-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oct-5-en-1-yne?
Yes, KEHONG BIO provides custom synthesis services for Oct-5-en-1-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.