Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate
TL;DR: Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate (CAS 84681-90-3) is a chemical compound with molecular formula C14H26O3 and molecular weight 242.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3,7-dimethyloct-6-enoxy)acetate
Also Known As: Ethyl[ oxy]acetate, EINECS 283-551-1, Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate, ethyl 2-(3,7-dimethyloct-6-enoxy)acetate, Ethyl [(3,7-dimethyloct-6-en-1-yl)oxy]acetate
| Molecular Formula | C14H26O3 |
|---|---|
| Molecular Weight | 242.19 g/mol |
| LogP | 3.3387 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 242.1882 |
| Heavy Atoms | 17 |
| Complexity | 229.62183 |
Chemical Identifiers
| CAS Number | 84681-90-3 |
|---|---|
| SMILES | CCOC(=O)COCCC(C)CCC=C(C)C |
Product Overview
Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate (CAS 84681-90-3), with molecular formula C14H26O3 and molecular weight 242.19 g/mol. IUPAC: ethyl 2-(3,7-dimethyloct-6-enoxy)acetate.
Chemical Property Profile of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate
Property Insights of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate
The XLogP value of 3.3387 indicates that Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate has 0 hydrogen bond donor(s) and 3 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 Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate?
The CAS number of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate is 84681-90-3.
What is the molecular formula of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate?
The molecular formula of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate is C14H26O3.
What is the molecular weight of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate?
The molecular weight of Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate is 242.19 g/mol.
Where can I buy Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate?
You can request a quote for Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl ((3,7-dimethyl-6-octenyl)oxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.