3-(3-Methoxybenzoyl)adipic acid
TL;DR: 3-(3-Methoxybenzoyl)adipic acid (CAS 17797-68-1) is a chemical compound with molecular formula C14H16O6 and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-methoxybenzoyl)hexanedioic acid
Also Known As: 3-(3-METHOXYBENZOYL)ADIPIC ACID, 3-(3-methoxybenzoyl)hexanedioic Acid, 663-122-9, RefChem:492087
| Molecular Formula | C14H16O6 |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 1.8336 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 280.0947 |
| Heavy Atoms | 20 |
| Complexity | 508.14053 |
Chemical Identifiers
| CAS Number | 17797-68-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)C(CCC(=O)O)CC(=O)O |
Product Overview
3-(3-Methoxybenzoyl)adipic acid (CAS 17797-68-1), with molecular formula C14H16O6 and molecular weight 280.09 g/mol. IUPAC: 3-(3-methoxybenzoyl)hexanedioic acid.
Chemical Property Profile of 3-(3-Methoxybenzoyl)adipic acid
Property Insights of 3-(3-Methoxybenzoyl)adipic acid
The XLogP value of 1.8336 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Methoxybenzoyl)adipic acid. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Methoxybenzoyl)adipic acid. Following Lipinski's Rule of Five, 3-(3-Methoxybenzoyl)adipic 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 3-(3-Methoxybenzoyl)adipic acid?
The CAS number of 3-(3-Methoxybenzoyl)adipic acid is 17797-68-1.
What is the molecular formula of 3-(3-Methoxybenzoyl)adipic acid?
The molecular formula of 3-(3-Methoxybenzoyl)adipic acid is C14H16O6.
What is the molecular weight of 3-(3-Methoxybenzoyl)adipic acid?
The molecular weight of 3-(3-Methoxybenzoyl)adipic acid is 280.09 g/mol.
Where can I buy 3-(3-Methoxybenzoyl)adipic acid?
You can request a quote for 3-(3-Methoxybenzoyl)adipic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Methoxybenzoyl)adipic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Methoxybenzoyl)adipic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.