![Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate structure](/static/products/841/84128-36-9.png)
Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate
TL;DR: Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate (CAS 84128-36-9) is a chemical compound with molecular formula C12H18O6 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate
Also Known As: NCIOpen2_002331, KST-1B8850, Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate, 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylic acid, dimethyl ester, A2064/0086803
| Molecular Formula | C12H18O6 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.11035 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 84128-36-9 |
|---|---|
| SMILES | COC(=O)C1C(OC2(O1)CCCCC2)C(=O)OC |
| InChIKey | QEMDNGOZZKFXRH-UHFFFAOYSA-N |
Product Overview
Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate (CAS 84128-36-9), with molecular formula C12H18O6 and molecular weight 258.11 g/mol. IUPAC: dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate.
Chemical Property Profile of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate
Property Insights of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate has 0 hydrogen bond donor(s) and 6 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 Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate?
The CAS number of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate is 84128-36-9.
What is the molecular formula of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate?
The molecular formula of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate is C12H18O6.
What is the molecular weight of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate?
The molecular weight of Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate is 258.11 g/mol.
Where can I buy Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate?
You can request a quote for Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 1,4-dioxaspiro[4.5]decane-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.