4-Butoxy-3-Ethoxybenzoic Acid
TL;DR: 4-Butoxy-3-Ethoxybenzoic Acid (CAS 101268-36-4) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-3-ethoxybenzoic acid
Also Known As: 4-butoxy-3-ethoxybenzoic acid, 4-butoxy-3-ethoxy-benzoic Acid, Benzoic acid, 4-butoxy-3-ethoxy-, 4-butoxy-3-ethoxybenzoicacid, (-)-Diacetyl-L-tartaricAcid
| Molecular Formula | C13H18O4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 2.9624 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 238.12051 |
| Heavy Atoms | 17 |
| Complexity | 373.68225 |
Chemical Identifiers
| CAS Number | 101268-36-4 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)C(=O)O)OCC |
Product Overview
4-Butoxy-3-Ethoxybenzoic Acid (CAS 101268-36-4), with molecular formula C13H18O4 and molecular weight 238.12 g/mol. IUPAC: 4-butoxy-3-ethoxybenzoic acid.
Chemical Property Profile of 4-Butoxy-3-Ethoxybenzoic Acid
Property Insights of 4-Butoxy-3-Ethoxybenzoic Acid
The XLogP value of 2.9624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Butoxy-3-Ethoxybenzoic Acid. With a topological polar surface area (TPSA) of 55.76 Ų, 4-Butoxy-3-Ethoxybenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butoxy-3-Ethoxybenzoic 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 4-Butoxy-3-Ethoxybenzoic Acid?
The CAS number of 4-Butoxy-3-Ethoxybenzoic Acid is 101268-36-4.
What is the molecular formula of 4-Butoxy-3-Ethoxybenzoic Acid?
The molecular formula of 4-Butoxy-3-Ethoxybenzoic Acid is C13H18O4.
What is the molecular weight of 4-Butoxy-3-Ethoxybenzoic Acid?
The molecular weight of 4-Butoxy-3-Ethoxybenzoic Acid is 238.12 g/mol.
Where can I buy 4-Butoxy-3-Ethoxybenzoic Acid?
You can request a quote for 4-Butoxy-3-Ethoxybenzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butoxy-3-Ethoxybenzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Butoxy-3-Ethoxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.