Cyclohexene, 4-ethynyl
TL;DR: Cyclohexene, 4-ethynyl (CAS 16388-31-1) is a chemical compound with molecular formula C8H10 and molecular weight 106.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethynylcyclohexene
Also Known As: 4-ethynylcyclohex-1-ene, 4-ethynylcyclohexene, Cyclohexene, 4-ethynyl, 4-ethynyl-cyclohexene, 4-ethynyl-1-cyclohexene
| Molecular Formula | C8H10 |
|---|---|
| Molecular Weight | 106.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.07825 |
| Heavy Atoms | 8 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 16388-31-1 |
|---|---|
| SMILES | C#CC1CCC=CC1 |
| InChIKey | ATMSQOAHGUFOMY-UHFFFAOYSA-N |
Product Overview
Cyclohexene, 4-ethynyl (CAS 16388-31-1), with molecular formula C8H10 and molecular weight 106.08 g/mol. IUPAC: 4-ethynylcyclohexene.
Chemical Property Profile of Cyclohexene, 4-ethynyl
Property Insights of Cyclohexene, 4-ethynyl
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexene, 4-ethynyl. With a topological polar surface area (TPSA) of 0.0 Ų, Cyclohexene, 4-ethynyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexene, 4-ethynyl 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 Cyclohexene, 4-ethynyl?
The CAS number of Cyclohexene, 4-ethynyl is 16388-31-1.
What is the molecular formula of Cyclohexene, 4-ethynyl?
The molecular formula of Cyclohexene, 4-ethynyl is C8H10.
What is the molecular weight of Cyclohexene, 4-ethynyl?
The molecular weight of Cyclohexene, 4-ethynyl is 106.08 g/mol.
Where can I buy Cyclohexene, 4-ethynyl?
You can request a quote for Cyclohexene, 4-ethynyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexene, 4-ethynyl?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexene, 4-ethynyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.