Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate
TL;DR: Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate (CAS 61367-60-0) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-oxatricyclo[3.2.1.02,4]oct-6-ene-6,7-dicarboxylate
Also Known As: J1.439.918F, dimethyl 3-oxatricyclo[3.2.1.02,4]oct-6-ene-6,7-dicarboxylate, Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate, (rac)-dimethyl 3-oxatricyclo[3.2.1.02,4]oct-6-ene-6,7-dicarboxylate, 5,6-Epoxybicyclo[2.2.1]hepta-2-ene-2,3-dicarboxylic acid dimethyl ester
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 61367-60-0 |
|---|---|
| SMILES | COC(=O)C1=C(C2CC1C3C2O3)C(=O)OC |
| InChIKey | OTBZXTBACQGRLH-UHFFFAOYSA-N |
Product Overview
Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate (CAS 61367-60-0), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: dimethyl 3-oxatricyclo[3.2.1.02,4]oct-6-ene-6,7-dicarboxylate.
Chemical Property Profile of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate
Property Insights of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate has 0 hydrogen bond donor(s) and 5 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 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate?
The CAS number of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate is 61367-60-0.
What is the molecular formula of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate?
The molecular formula of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate is C11H12O5.
What is the molecular weight of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate?
The molecular weight of Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate is 224.07 g/mol.
Where can I buy Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate?
You can request a quote for Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3-oxatricyclo[3.2.1.0~2,4~]oct-6-ene-6,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.