7-Ethoxy-3,7-dimethyloct-1-yn-3-ol
TL;DR: 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol (CAS 2154-14-5) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethoxy-3,7-dimethyloct-1-yn-3-ol
Also Known As: 7-ethoxy-3,7-dimethyloct-1-yn-3-ol, starbld0046530, 7-ethoxy-3,7-dimethyl-oct-1-yn-3-ol
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 2.356 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 198.8575 |
Chemical Identifiers
| CAS Number | 2154-14-5 |
|---|---|
| SMILES | CCOC(C)(C)CCCC(C)(C#C)O |
Product Overview
7-Ethoxy-3,7-dimethyloct-1-yn-3-ol (CAS 2154-14-5), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: 7-ethoxy-3,7-dimethyloct-1-yn-3-ol.
Chemical Property Profile of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol
Property Insights of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol
The XLogP value of 2.356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol. With a topological polar surface area (TPSA) of 29.46 Ų, 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol has 1 hydrogen bond donor(s) and 2 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 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol?
The CAS number of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol is 2154-14-5.
What is the molecular formula of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol?
The molecular formula of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol is C12H22O2.
What is the molecular weight of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol?
The molecular weight of 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol is 198.16 g/mol.
Where can I buy 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol?
You can request a quote for 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 7-Ethoxy-3,7-dimethyloct-1-yn-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.