1-Ethynylcyclohexanol
TL;DR: 1-Ethynylcyclohexanol (CAS 78-27-3) is a chemical compound with molecular formula C8H12O and molecular weight 124.08881 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethynylcyclohexan-1-ol
Also Known As: 1-Ethynyl-1-cyclohexanol, 1-Ethynylcyclohexanol, 1-Ethynylcyclohexan-1-ol, Ethynylcyclohexanol, (1-Hydroxycyclohexyl)ethyne
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H12O |
| Molecular Weight | 124.08881 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 124.08881 Da |
| Heavy Atoms | 9 |
| Complexity | 134.0 |
| Vapor Pressure | 0.13 [mmHg] |
| SMILES | C#CC1(CCCCC1)O |
| InChIKey | QYLFHLNFIHBCPR-UHFFFAOYSA-N |
Product Description
Applications: 1-Ethynylcyclohexanol is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A polymer intermediate supplied by CoreyChem, 1-Ethynylcyclohexanol (CAS 78-27-3) has the molecular formula C8H12O and a molecular weight of 124.09 g/mol. Synonyms include 1-Ethynyl-1-cyclohexanol and 1-Ethynylcyclohexanol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-Ethynylcyclohexanol
Property Insights of 1-Ethynylcyclohexanol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethynylcyclohexanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Ethynylcyclohexanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethynylcyclohexanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Ethynylcyclohexanol?
The CAS number of 1-Ethynylcyclohexanol is 78-27-3.
What is the molecular formula of 1-Ethynylcyclohexanol?
The molecular formula of 1-Ethynylcyclohexanol is C8H12O.
What is the molecular weight of 1-Ethynylcyclohexanol?
The molecular weight of 1-Ethynylcyclohexanol is 124.08881 g/mol.
What are the applications of 1-Ethynylcyclohexanol?
1-Ethynylcyclohexanol is used in polymer chemistry and functional materials synthesis, as well as polymer additives and plastics compounding. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to...
Where can I buy 1-Ethynylcyclohexanol?
You can request a quote for 1-Ethynylcyclohexanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Ethynylcyclohexanol?
Yes, CoreyChem provides custom synthesis services for 1-Ethynylcyclohexanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.