3-Methoxy-2-(4-methoxybenzoyl)benzoic acid
TL;DR: 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid (CAS 80764-47-2) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-2-(4-methoxybenzoyl)benzoic acid
Also Known As: 3-methoxy-2-(4-methoxybenzoyl)benzoic acid
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 80764-47-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C2=C(C=CC=C2OC)C(=O)O |
| InChIKey | BJGQPFZFRBJQPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxy-2-(4-methoxybenzoyl)benzoic acid (CAS 80764-47-2), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: 3-methoxy-2-(4-methoxybenzoyl)benzoic acid.
Chemical Property Profile of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid
Property Insights of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid. Following Lipinski's Rule of Five, 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid has 1 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 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid?
The CAS number of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid is 80764-47-2.
What is the molecular formula of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid?
The molecular formula of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid is C16H14O5.
What is the molecular weight of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid?
The molecular weight of 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid is 286.08 g/mol.
Where can I buy 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid?
You can request a quote for 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-2-(4-methoxybenzoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.