Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate
TL;DR: Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate (CAS 116279-89-1) is a chemical compound with molecular formula C22H22O4 and molecular weight 350.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,15-dicarboxylate
Also Known As: diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate, diethyl endo-dihydro-9,10-ethanoanthracenedicarboxylate, diethyl tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,15-dicarboxylate, DIETHYL 9,10-DIHYDRO-9,10-ETHANO-ANTHRACENE-11,11-DICARBOXYLATE, 15,15-diethyl tetracyclo[6.6.2.0?,?.0?,??]hexadeca-2(7),3,5,9(14),10,12-hexaene-15,15-dicarboxylate
| Molecular Formula | C22H22O4 |
|---|---|
| Molecular Weight | 350.15 g/mol |
| LogP | 3.7801 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.1518 |
| Heavy Atoms | 26 |
| Complexity | 804.4509 |
Chemical Identifiers
| CAS Number | 116279-89-1 |
|---|---|
| SMILES | CCOC(=O)C1(CC2C3=CC=CC=C3C1C4=CC=CC=C24)C(=O)OCC |
Product Overview
Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate (CAS 116279-89-1), with molecular formula C22H22O4 and molecular weight 350.15 g/mol. IUPAC: diethyl tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,15-dicarboxylate.
Chemical Property Profile of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate
Property Insights of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate
The XLogP value of 3.7801 indicates that Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate 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 Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate?
The CAS number of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate is 116279-89-1.
What is the molecular formula of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate?
The molecular formula of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate is C22H22O4.
What is the molecular weight of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate?
The molecular weight of Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate is 350.15 g/mol.
Where can I buy Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate?
You can request a quote for Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 9,10-dihydro-9,10-ethanoanthracene-11,11-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.