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Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate
TL;DR: Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate (CAS 13747-72-3) 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 1,4-dioxaspiro[4.5]decane-6-carboxylate
Also Known As: Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate, ethyl 1,4-dioxa-spiro[4,5]decane-6-carboxylate, ethyl 1,4-dioxaspiro(4.5)decane-6-carboxylate, ethyl 1,4-dioxaspiro[4.5]decane-10-carboxylate, Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate #
| Molecular Formula | C11H18O4 |
|---|---|
| Molecular Weight | 214.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.12051 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 13747-72-3 |
|---|---|
| SMILES | CCOC(=O)C1CCCCC12OCCO2 |
| InChIKey | QMFOXYVOKMOHCN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate (CAS 13747-72-3), with molecular formula C11H18O4 and molecular weight 214.12 g/mol. IUPAC: ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate.
Chemical Property Profile of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate
Property Insights of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate. With a topological polar surface area (TPSA) of 44.8 Ų, Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1,4-dioxaspiro[4.5]decane-6-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 1,4-dioxaspiro[4.5]decane-6-carboxylate?
The CAS number of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate is 13747-72-3.
What is the molecular formula of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate?
The molecular formula of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate is C11H18O4.
What is the molecular weight of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate?
The molecular weight of Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate is 214.12 g/mol.
Where can I buy Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate?
You can request a quote for Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1,4-dioxaspiro[4.5]decane-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.