Dibenzylmalonic acid
TL;DR: Dibenzylmalonic acid (CAS 4372-32-1) is a chemical compound with molecular formula C17H16O4 and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dibenzylpropanedioic acid
Also Known As: Dibenzylmalonic acid, 2,2-Dibenzylmalonic acid, dibenzylpropanedioic acid, 2,2-dibenzylpropanedioic acid, 2,2-Bis(phenylmethyl)propanedioic acid
| Molecular Formula | C17H16O4 |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.10486 |
| Heavy Atoms | 21 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 4372-32-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(CC2=CC=CC=C2)(C(=O)O)C(=O)O |
| InChIKey | YSZJTDBKDUARSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzylmalonic acid (CAS 4372-32-1), with molecular formula C17H16O4 and molecular weight 284.10 g/mol. IUPAC: 2,2-dibenzylpropanedioic acid.
Chemical Property Profile of Dibenzylmalonic acid
Property Insights of Dibenzylmalonic acid
The XLogP value of 3.3 indicates that Dibenzylmalonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzylmalonic acid. Following Lipinski's Rule of Five, Dibenzylmalonic acid has 2 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 Dibenzylmalonic acid?
The CAS number of Dibenzylmalonic acid is 4372-32-1.
What is the molecular formula of Dibenzylmalonic acid?
The molecular formula of Dibenzylmalonic acid is C17H16O4.
What is the molecular weight of Dibenzylmalonic acid?
The molecular weight of Dibenzylmalonic acid is 284.10 g/mol.
Where can I buy Dibenzylmalonic acid?
You can request a quote for Dibenzylmalonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzylmalonic acid?
Yes, KEHONG BIO provides custom synthesis services for Dibenzylmalonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.