Benzoic acid, 4,4'-carbonylbis-, dimethyl ester
TL;DR: Benzoic acid, 4,4'-carbonylbis-, dimethyl ester (CAS 1233-73-4) is a chemical compound with molecular formula C17H14O5 and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-methoxycarbonylbenzoyl)benzoate
Also Known As: dimethyl 4,4'-carbonyldibenzoate, methyl 4-(4-methoxycarbonylbenzoyl)benzoate, Benzoic acid, 4,4'-carbonylbis-, dimethyl ester, Bis(4-methoxycarbonylphenyl)methanone, 4,4'-Bis-methoxycarbonyl-benzophenone
| Molecular Formula | C17H14O5 |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.08414 |
| Heavy Atoms | 22 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 1233-73-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OC |
| InChIKey | LASYICLJGDSRSM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 4,4'-carbonylbis-, dimethyl ester (CAS 1233-73-4), with molecular formula C17H14O5 and molecular weight 298.08 g/mol. IUPAC: methyl 4-(4-methoxycarbonylbenzoyl)benzoate.
Chemical Property Profile of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester
Property Insights of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester
The XLogP value of 3.6 indicates that Benzoic acid, 4,4'-carbonylbis-, dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4,4'-carbonylbis-, dimethyl ester. Following Lipinski's Rule of Five, Benzoic acid, 4,4'-carbonylbis-, dimethyl ester 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 Benzoic acid, 4,4'-carbonylbis-, dimethyl ester?
The CAS number of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester is 1233-73-4.
What is the molecular formula of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester?
The molecular formula of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester is C17H14O5.
What is the molecular weight of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester?
The molecular weight of Benzoic acid, 4,4'-carbonylbis-, dimethyl ester is 298.08 g/mol.
Where can I buy Benzoic acid, 4,4'-carbonylbis-, dimethyl ester?
You can request a quote for Benzoic acid, 4,4'-carbonylbis-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4,4'-carbonylbis-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4,4'-carbonylbis-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.