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Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate
TL;DR: Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate (CAS 37487-95-9) is a chemical compound with molecular formula C11H18O4 and molecular weight 214.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate
Also Known As: ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate, ethyl5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate, ethyl 7,7-dimethyl-2,6-dioxaspiro[2.5]octane-1-carboxylate
| Molecular Formula | C11H18O4 |
|---|---|
| Molecular Weight | 214.12 g/mol |
| LogP | 1.2761 |
| Topological Polar Surface Area | 48.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.12051 |
| Heavy Atoms | 15 |
| Complexity | 273.76147 |
Chemical Identifiers
| CAS Number | 37487-95-9 |
|---|---|
| SMILES | CCOC(=O)C1C2(O1)CCOC(C2)(C)C |
Product Overview
Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate (CAS 37487-95-9), with molecular formula C11H18O4 and molecular weight 214.12 g/mol. IUPAC: ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate.
Chemical Property Profile of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate
Property Insights of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate
The XLogP value of 1.2761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate. With a topological polar surface area (TPSA) of 48.06 Ų, Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate has 0 hydrogen bond donor(s) and 4 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 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate?
The CAS number of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate is 37487-95-9.
What is the molecular formula of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate?
The molecular formula of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate is C11H18O4.
What is the molecular weight of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate?
The molecular weight of Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate is 214.12 g/mol.
Where can I buy Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate?
You can request a quote for Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-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 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5,5-dimethyl-1,6-dioxaspiro[2.5]octane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.