Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate
TL;DR: Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate (CAS 54783-25-4) is a chemical compound with molecular formula C17H32O3 and molecular weight 284.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate
Also Known As: EINECS 259-344-7, Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate, 2,3-Epoxy-3,7,11-trimethyl-dodecansaeure-aethylester, 2-Oxiranecarboxylicacid, 3-(4,8-dimethylnonyl)-3-methyl-, ethyl ester, 3-(4,8-Dimethylnonyl)-3-methyloxirane-2-carboxylic acid ethyl ester
| Molecular Formula | C17H32O3 |
|---|---|
| Molecular Weight | 284.24 g/mol |
| LogP | 4.3397 |
| Topological Polar Surface Area | 38.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 284.23514 |
| Heavy Atoms | 20 |
| Complexity | 300.61023 |
Chemical Identifiers
| CAS Number | 54783-25-4 |
|---|---|
| SMILES | CCOC(=O)C1C(O1)(C)CCCC(C)CCCC(C)C |
Product Overview
Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate (CAS 54783-25-4), with molecular formula C17H32O3 and molecular weight 284.24 g/mol. IUPAC: ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate.
Chemical Property Profile of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate
Property Insights of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate
The XLogP value of 4.3397 indicates that Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.83 Ų, Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate 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-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate?
The CAS number of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate is 54783-25-4.
What is the molecular formula of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate?
The molecular formula of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate is C17H32O3.
What is the molecular weight of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate?
The molecular weight of Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate is 284.24 g/mol.
Where can I buy Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate?
You can request a quote for Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4,8-dimethylnonyl)-3-methyloxirane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.