3-(3-Fluoro-4-methoxybenzoyl)propionic acid
TL;DR: 3-(3-Fluoro-4-methoxybenzoyl)propionic acid (CAS 347-63-7) is a chemical compound with molecular formula C11H11FO4 and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoic acid
Also Known As: 3-(3-Fluoro-4-methoxybenzoyl)propionic acid, 4-(3-Fluoro-4-methoxyphenyl)-4-oxobutanoic acid, 3- propionicacid, zlchem 1107, 3-(3-Fluoro-para-anisoyl)-propionic acid
| Molecular Formula | C11H11FO4 |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.06413 |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 347-63-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CCC(=O)O)F |
| InChIKey | SNRFVYKMDZSFED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-Fluoro-4-methoxybenzoyl)propionic acid (CAS 347-63-7), with molecular formula C11H11FO4 and molecular weight 226.06 g/mol. IUPAC: 4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoic acid.
Chemical Property Profile of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid
Property Insights of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Fluoro-4-methoxybenzoyl)propionic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Fluoro-4-methoxybenzoyl)propionic acid. Following Lipinski's Rule of Five, 3-(3-Fluoro-4-methoxybenzoyl)propionic 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-(3-Fluoro-4-methoxybenzoyl)propionic acid?
The CAS number of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid is 347-63-7.
What is the molecular formula of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid?
The molecular formula of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid is C11H11FO4.
What is the molecular weight of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid?
The molecular weight of 3-(3-Fluoro-4-methoxybenzoyl)propionic acid is 226.06 g/mol.
Where can I buy 3-(3-Fluoro-4-methoxybenzoyl)propionic acid?
You can request a quote for 3-(3-Fluoro-4-methoxybenzoyl)propionic 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-Fluoro-4-methoxybenzoyl)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Fluoro-4-methoxybenzoyl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.