Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate
TL;DR: Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate (CAS 22483-52-9) is a chemical compound with molecular formula C14H14O8 and molecular weight 310.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(ethoxycarbonyl) benzene-1,3-dicarboxylate
Also Known As: Diethyl 1,3-phenylenedicarbonyl biscarbonate, Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate, Isophthalic acid, dianhydride with diethyl bis(hydrogen carbonate), bis(ethoxycarbonyl) benzene-1,3-dicarboxylate, Diethyl (1,3-phenylene)dicarbonyl biscarbonate
| Molecular Formula | C14H14O8 |
|---|---|
| Molecular Weight | 310.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.06888 |
| Heavy Atoms | 22 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 22483-52-9 |
|---|---|
| SMILES | CCOC(=O)OC(=O)C1=CC(=CC=C1)C(=O)OC(=O)OCC |
| InChIKey | SXIBCLRNZISNIZ-UHFFFAOYSA-N |
Product Overview
Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate (CAS 22483-52-9), with molecular formula C14H14O8 and molecular weight 310.07 g/mol. IUPAC: bis(ethoxycarbonyl) benzene-1,3-dicarboxylate.
Chemical Property Profile of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate
Property Insights of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate. Following Lipinski's Rule of Five, Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate has 0 hydrogen bond donor(s) and 8 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 Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate?
The CAS number of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate is 22483-52-9.
What is the molecular formula of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate?
The molecular formula of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate is C14H14O8.
What is the molecular weight of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate?
The molecular weight of Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate is 310.07 g/mol.
Where can I buy Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate?
You can request a quote for Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Bis(ethoxycarbonyl)benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.