Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate
TL;DR: Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate (CAS 6319-56-8) is a chemical compound with molecular formula C14H18O5 and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(prop-2-enyl) 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate
Also Known As: Aiallyl4,5-epoxyhexahydrophthalate, Aiallyl 4,5-epoxyhexahydrophthalate, Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate, 4,5-Epoxy-cyclohexan-1,2-dicarbonsaeure-diallylester, bis(prop-2-enyl) 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate
| Molecular Formula | C14H18O5 |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 266.11542 |
| Heavy Atoms | 19 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 6319-56-8 |
|---|---|
| SMILES | C=CCOC(=O)C1CC2C(O2)CC1C(=O)OCC=C |
| InChIKey | CATDJXLIBJDBGK-UHFFFAOYSA-N |
Product Overview
Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate (CAS 6319-56-8), with molecular formula C14H18O5 and molecular weight 266.12 g/mol. IUPAC: bis(prop-2-enyl) 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate.
Chemical Property Profile of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate
Property Insights of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate. Following Lipinski's Rule of Five, Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-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 Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate?
The CAS number of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate is 6319-56-8.
What is the molecular formula of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate?
The molecular formula of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate is C14H18O5.
What is the molecular weight of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate?
The molecular weight of Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate is 266.12 g/mol.
Where can I buy Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate?
You can request a quote for Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diallyl 7-oxabicyclo(4.1.0)heptane-3,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.