Hexa-2-yn-4-ene, 4-ethyl-, (E)-
TL;DR: Hexa-2-yn-4-ene, 4-ethyl-, (E)- (CAS 70058-03-6) 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)-3-ethylhex-2-en-4-yne
Also Known As: Hexa-2-yn-4-ene, 4-ethyl-, (E)-, (E)-3-ethylhex-2-en-4-yne, Hexa-2-yn-4-ene,4-ethyl-, -, Hexa-2-yn-4-ene, 4-ethyl-,(E)-, 2-Hexen-4-yne,3-ethyl-, (E)- (9CI)
| 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 | 1 |
| Exact Mass | 108.0939 |
| Heavy Atoms | 8 |
| Complexity | 129.85263 |
Chemical Identifiers
| CAS Number | 70058-03-6 |
|---|---|
| SMILES | CC/C(=C\C)/C#CC |
Product Overview
Hexa-2-yn-4-ene, 4-ethyl-, (E)- (CAS 70058-03-6), with molecular formula C8H12 and molecular weight 108.09 g/mol. IUPAC: (E)-3-ethylhex-2-en-4-yne.
Chemical Property Profile of Hexa-2-yn-4-ene, 4-ethyl-, (E)-
Property Insights of Hexa-2-yn-4-ene, 4-ethyl-, (E)-
The XLogP value of 2.366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexa-2-yn-4-ene, 4-ethyl-, (E)-. With a topological polar surface area (TPSA) of 0.0 Ų, Hexa-2-yn-4-ene, 4-ethyl-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexa-2-yn-4-ene, 4-ethyl-, (E)- 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 Hexa-2-yn-4-ene, 4-ethyl-, (E)-?
The CAS number of Hexa-2-yn-4-ene, 4-ethyl-, (E)- is 70058-03-6.
What is the molecular formula of Hexa-2-yn-4-ene, 4-ethyl-, (E)-?
The molecular formula of Hexa-2-yn-4-ene, 4-ethyl-, (E)- is C8H12.
What is the molecular weight of Hexa-2-yn-4-ene, 4-ethyl-, (E)-?
The molecular weight of Hexa-2-yn-4-ene, 4-ethyl-, (E)- is 108.09 g/mol.
Where can I buy Hexa-2-yn-4-ene, 4-ethyl-, (E)-?
You can request a quote for Hexa-2-yn-4-ene, 4-ethyl-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexa-2-yn-4-ene, 4-ethyl-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Hexa-2-yn-4-ene, 4-ethyl-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.