Dimethyl 4,4'-biphenyldicarboxylate
TL;DR: Dimethyl 4,4'-biphenyldicarboxylate (CAS 792-74-5) is a chemical compound with molecular formula C16H14O4 and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-methoxycarbonylphenyl)benzoate
Also Known As: dimethyl [1,1'-biphenyl]-4,4'-dicarboxylate, Nissel, Dimethyl biphenyl-4,4'-dicarboxylate, Biphenyl dimethyl dicarboxylate, DIMETHYL 4,4'-BIPHENYLDICARBOXYLATE
| Molecular Formula | C16H14O4 |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.0892 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 792-74-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC |
| InChIKey | BKRIRZXWWALTPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl 4,4'-biphenyldicarboxylate (CAS 792-74-5), with molecular formula C16H14O4 and molecular weight 270.09 g/mol. IUPAC: methyl 4-(4-methoxycarbonylphenyl)benzoate.
Chemical Property Profile of Dimethyl 4,4'-biphenyldicarboxylate
Property Insights of Dimethyl 4,4'-biphenyldicarboxylate
The XLogP value of 3.9 indicates that Dimethyl 4,4'-biphenyldicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 4,4'-biphenyldicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 4,4'-biphenyldicarboxylate 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 4,4'-biphenyldicarboxylate?
The CAS number of Dimethyl 4,4'-biphenyldicarboxylate is 792-74-5.
What is the molecular formula of Dimethyl 4,4'-biphenyldicarboxylate?
The molecular formula of Dimethyl 4,4'-biphenyldicarboxylate is C16H14O4.
What is the molecular weight of Dimethyl 4,4'-biphenyldicarboxylate?
The molecular weight of Dimethyl 4,4'-biphenyldicarboxylate is 270.09 g/mol.
Where can I buy Dimethyl 4,4'-biphenyldicarboxylate?
You can request a quote for Dimethyl 4,4'-biphenyldicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4,4'-biphenyldicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4,4'-biphenyldicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.