Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate
TL;DR: Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate (CAS 74821-68-4) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl tricyclo[4.2.2.02,5]dec-9-ene-7,8-dicarboxylate
Also Known As: Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate, (2arH.6acH)-octahydro-3t.6t-etheno-cyclobutabenzene-dicarbox
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 74821-68-4 |
|---|---|
| SMILES | COC(=O)C1C2C=CC(C1C(=O)OC)C3C2CC3 |
| InChIKey | VTKWZUHHRZVSOJ-UHFFFAOYSA-N |
Product Overview
Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate (CAS 74821-68-4), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: dimethyl tricyclo[4.2.2.02,5]dec-9-ene-7,8-dicarboxylate.
Chemical Property Profile of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate
Property Insights of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-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 Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?
The CAS number of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is 74821-68-4.
What is the molecular formula of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?
The molecular formula of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is C14H18O4.
What is the molecular weight of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?
The molecular weight of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is 250.12 g/mol.
Where can I buy Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?
You can request a quote for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.