Dibenzyl benzene-1,3-dicarboxylate
TL;DR: Dibenzyl benzene-1,3-dicarboxylate (CAS 16034-14-3) is a chemical compound with molecular formula C22H18O4 and molecular weight 346.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dibenzyl benzene-1,3-dicarboxylate
Also Known As: dibenzyl isophthalate, DIBENZYL PHTHALATE, dibenzyl benzene-1,3-dicarboxylate, isophthalic acid dibenzyl ester, J1.224.961F
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H18O4 |
| Molecular Weight | 346.1205 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 346.1205 Da |
| Heavy Atoms | 26 |
| Complexity | 409.0 |
| SMILES | C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)C(=O)OCC3=CC=CC=C3 |
| InChIKey | OIVQLSUKOZNNCT-UHFFFAOYSA-N |
Product Description
Applications: Dibenzyl benzene-1,3-dicarboxylate is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dibenzyl benzene-1,3-dicarboxylate (CAS 16034-14-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Dibenzyl benzene-1,3-dicarboxylate (CAS 16034-14-3) is a organic building block with the molecular formula C22H18O4 and a molecular weight of 346.12 g/mol. It is also known as dibenzyl isophthalate and DIBENZYL PHTHALATE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Dibenzyl benzene-1,3-dicarboxylate
Property Insights of Dibenzyl benzene-1,3-dicarboxylate
The XLogP value of 5.3 indicates that Dibenzyl benzene-1,3-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, Dibenzyl benzene-1,3-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzyl benzene-1,3-dicarboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dibenzyl benzene-1,3-dicarboxylate?
The CAS number of Dibenzyl benzene-1,3-dicarboxylate is 16034-14-3.
What is the molecular formula of Dibenzyl benzene-1,3-dicarboxylate?
The molecular formula of Dibenzyl benzene-1,3-dicarboxylate is C22H18O4.
What is the molecular weight of Dibenzyl benzene-1,3-dicarboxylate?
The molecular weight of Dibenzyl benzene-1,3-dicarboxylate is 346.1205 g/mol.
What are the applications of Dibenzyl benzene-1,3-dicarboxylate?
Dibenzyl benzene-1,3-dicarboxylate is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dibenzyl...
Where can I buy Dibenzyl benzene-1,3-dicarboxylate?
You can request a quote for Dibenzyl benzene-1,3-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenzyl benzene-1,3-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for Dibenzyl benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.