3-Butoxy-4-methoxybenzoic acid
TL;DR: 3-Butoxy-4-methoxybenzoic acid (CAS 66924-20-7) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butoxy-4-methoxybenzoic acid
Also Known As: 3-butoxy-4-methoxybenzoic acid, Maybridge1_005149, Benzoic acid, 3-butoxy-4-methoxy-, 3-n-Butoxy-4-methoxybenzoic acid, 3-butoxy-4-methoxy-benzoic acid
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 2.5723 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 360.03644 |
Chemical Identifiers
| CAS Number | 66924-20-7 |
|---|---|
| SMILES | CCCCOC1=C(C=CC(=C1)C(=O)O)OC |
Product Overview
3-Butoxy-4-methoxybenzoic acid (CAS 66924-20-7), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: 3-butoxy-4-methoxybenzoic acid.
Chemical Property Profile of 3-Butoxy-4-methoxybenzoic acid
Property Insights of 3-Butoxy-4-methoxybenzoic acid
The XLogP value of 2.5723 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Butoxy-4-methoxybenzoic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 3-Butoxy-4-methoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butoxy-4-methoxybenzoic acid has 1 hydrogen bond donor(s) and 3 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-Butoxy-4-methoxybenzoic acid?
The CAS number of 3-Butoxy-4-methoxybenzoic acid is 66924-20-7.
What is the molecular formula of 3-Butoxy-4-methoxybenzoic acid?
The molecular formula of 3-Butoxy-4-methoxybenzoic acid is C12H16O4.
What is the molecular weight of 3-Butoxy-4-methoxybenzoic acid?
The molecular weight of 3-Butoxy-4-methoxybenzoic acid is 224.10 g/mol.
Where can I buy 3-Butoxy-4-methoxybenzoic acid?
You can request a quote for 3-Butoxy-4-methoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butoxy-4-methoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Butoxy-4-methoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.